Ligand source activities (1 row/activity)
Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Potency) |
# tested GPCRs (Potency) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
1185 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
1185 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
3038517 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
CHEMBL22055 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
DB06494 | 3645 | 32 | None | -5 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
53386917 | 63189 | 0 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800156 | 63189 | 0 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53388960 | 63237 | 0 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 682 | 11 | 2 | 9 | 6.0 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800663 | 63237 | 0 | None | - | 1 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 682 | 11 | 2 | 9 | 6.0 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
11512905 | 137890 | 0 | None | 1778 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL377396 | 137890 | 0 | None | 1778 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
9961721 | 167914 | 0 | None | 60 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL435167 | 167914 | 0 | None | 60 | 2 | Human | 10.2 | pIC50 | = | 10.2 | Functional | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
53388958 | 63235 | 0 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800661 | 63235 | 0 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
18324807 | 63242 | 0 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800668 | 63242 | 0 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
20691661 | 79203 | 0 | None | 138 | 2 | Human | 10.0 | pIC50 | = | 10 | Functional | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211485 | 79203 | 0 | None | 138 | 2 | Human | 10.0 | pIC50 | = | 10 | Functional | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
10100930 | 63188 | 0 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800155 | 63188 | 0 | None | - | 1 | Human | 9.8 | pIC50 | = | 9.8 | Functional | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386915 | 63186 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800153 | 63186 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53389117 | 63240 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 688 | 11 | 2 | 9 | 4.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN2CCCC2=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800666 | 63240 | 0 | None | - | 1 | Human | 9.7 | pIC50 | = | 9.7 | Functional | ChEMBL | 688 | 11 | 2 | 9 | 4.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN2CCCC2=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53389115 | 63238 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 698 | 11 | 3 | 10 | 5.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccc(CO)n2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800664 | 63238 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 698 | 11 | 3 | 10 | 5.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccc(CO)n2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53387071 | 63190 | 4 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800157 | 63190 | 4 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
10371708 | 63191 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800158 | 63191 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53389118 | 63241 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 712 | 12 | 2 | 10 | 4.2 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN(C)S(C)(=O)=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800667 | 63241 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | 712 | 12 | 2 | 10 | 4.2 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN(C)S(C)(=O)=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53386756 | 63243 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 617 | 13 | 2 | 10 | 3.6 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCOC)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800669 | 63243 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 617 | 13 | 2 | 10 | 3.6 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCOC)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
44293301 | 187921 | 0 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50283 | 187921 | 0 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
16221494 | 161403 | 0 | None | 8 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL415659 | 161403 | 0 | None | 8 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
10348973 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
53386757 | 63244 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 631 | 14 | 2 | 10 | 4.0 | CCOCCn1c(=O)c2c(CN(C)CCOC)c(-c3ccc(NC(=O)NOC)cc3)sc2n(Cc2c(F)cccc2F)c1=O | 10.1021/jm200216q | ||
CHEMBL1800670 | 63244 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 631 | 14 | 2 | 10 | 4.0 | CCOCCn1c(=O)c2c(CN(C)CCOC)c(-c3ccc(NC(=O)NOC)cc3)sc2n(Cc2c(F)cccc2F)c1=O | 10.1021/jm200216q | ||
10100930 | 63188 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800155 | 63188 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386917 | 63189 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800156 | 63189 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
11421412 | 178164 | 11 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL468551 | 178164 | 11 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
11477988 | 90579 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23969 | 90579 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
16155709 | 167910 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 1661 | 42 | 17 | 19 | 1.7 | CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL435141 | 167910 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 1661 | 42 | 17 | 19 | 1.7 | CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16155709 | 167910 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 1661 | 42 | 17 | 19 | 1.7 | CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL435141 | 167910 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 1661 | 42 | 17 | 19 | 1.7 | CONC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL262747 | 208801 | 8 | None | 1 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||||
101755083 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
101755083 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm060240a | ||||
44293163 | 188115 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50433 | 188115 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL407661 | 210928 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
11262242 | 188152 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL505033 | 188152 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
16221267 | 141470 | 0 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL387499 | 141470 | 0 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
23656390 | 161134 | 0 | None | 4 | 2 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL413245 | 161134 | 0 | None | 4 | 2 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
1184 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
9874838 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
CHEMBL71917 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
1184 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
9874838 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL71917 | 3676 | 31 | None | 2 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL407661 | 210928 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL262747 | 208801 | 8 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL262747 | 208801 | 8 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL434380 | 211906 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@@H](C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)cc1 | 10.1021/jm060240a | ||||
44395623 | 124137 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 551 | 7 | 3 | 8 | 5.3 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL364167 | 124137 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 551 | 7 | 3 | 8 | 5.3 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL434380 | 211906 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@@H](C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)cc1 | 10.1021/jm060240a | ||||
16221104 | 85133 | 0 | None | 6 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)Sc2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL227861 | 85133 | 0 | None | 6 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)Sc2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
87285768 | 169927 | 1 | None | 158 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | 158 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
22129998 | 100805 | 0 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296321 | 100805 | 0 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
16156699 | 166013 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1647 | 41 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL427976 | 166013 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1647 | 41 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16221266 | 165806 | 0 | None | 2 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL427438 | 165806 | 0 | None | 2 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
44395435 | 123295 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 523 | 7 | 3 | 8 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL362371 | 123295 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 523 | 7 | 3 | 8 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
16221495 | 85098 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL227451 | 85098 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
16156699 | 166013 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1647 | 41 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL427976 | 166013 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1647 | 41 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
10348973 | 3261 | 50 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
9895596 | 63185 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800152 | 63185 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
16221556 | 167786 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1580 | 41 | 14 | 17 | 2.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(N)=O)[S+](C)[O-])cc1 | 10.1021/jm0613931 | ||
CHEMBL434371 | 167786 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1580 | 41 | 14 | 17 | 2.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(N)=O)[S+](C)[O-])cc1 | 10.1021/jm0613931 | ||
CHEMBL429527 | 211788 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
155531714 | 175617 | 0 | None | 501 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | 501 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL429527 | 211788 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NO)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
16221496 | 142215 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1580 | 41 | 14 | 17 | 2.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C(N)=O)[S+](C)[O-])cc1 | 10.1021/jm0613931 | ||
CHEMBL389248 | 142215 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1580 | 41 | 14 | 17 | 2.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C(N)=O)[S+](C)[O-])cc1 | 10.1021/jm0613931 | ||
16156573 | 168310 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1747 | 48 | 17 | 20 | 2.2 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL438239 | 168310 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1747 | 48 | 17 | 20 | 2.2 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16156573 | 168310 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1747 | 48 | 17 | 20 | 2.2 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL438239 | 168310 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 1747 | 48 | 17 | 20 | 2.2 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
10649568 | 14397 | 0 | None | 4 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL120432 | 14397 | 0 | None | 4 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL219061 | 207659 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL219061 | 207659 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
53387071 | 63190 | 4 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800157 | 63190 | 4 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
10371708 | 63191 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800158 | 63191 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
10649568 | 14397 | 0 | None | 4 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm701249f | ||
CHEMBL120432 | 14397 | 0 | None | 4 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm701249f | ||
53386916 | 63187 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 654 | 11 | 2 | 10 | 4.5 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(F)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800154 | 63187 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 654 | 11 | 2 | 10 | 4.5 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(F)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
10649568 | 14397 | 0 | None | 4 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 4 | 2 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
44321052 | 204548 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 578 | 9 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86912 | 204548 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 578 | 9 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
16155593 | 157891 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 1767 | 53 | 17 | 21 | 2.2 | CONC(=O)NCCOCCOCCOCCC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL409044 | 157891 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 1767 | 53 | 17 | 21 | 2.2 | CONC(=O)NCCOCCOCCOCCC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16155593 | 157891 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 1767 | 53 | 17 | 21 | 2.2 | CONC(=O)NCCOCCOCCOCCC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL409044 | 157891 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 1767 | 53 | 17 | 21 | 2.2 | CONC(=O)NCCOCCOCCOCCC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL409043 | 210996 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL409043 | 210996 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
16221433 | 141631 | 0 | None | 1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL388369 | 141631 | 0 | None | 1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
16221211 | 168696 | 0 | None | 2 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL441211 | 168696 | 0 | None | 2 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
44432651 | 86276 | 0 | None | 21 | 2 | Rat | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231760 | 86276 | 0 | None | 21 | 2 | Rat | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
53386915 | 63186 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800153 | 63186 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
44395650 | 168755 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 4.9 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL441676 | 168755 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 4.9 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL2105773 | 210994 | 7 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||||
CHEMBL409018 | 210994 | 7 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||||
16155157 | 96001 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1622 | 44 | 16 | 18 | 3.6 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL262180 | 96001 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1622 | 44 | 16 | 18 | 3.6 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398152 | 159668 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1675 | 42 | 17 | 20 | 0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL410967 | 159668 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1675 | 42 | 17 | 20 | 0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16155157 | 96001 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1622 | 44 | 16 | 18 | 3.6 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL262180 | 96001 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 1622 | 44 | 16 | 18 | 3.6 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL2105773 | 210994 | 7 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||||
CHEMBL409018 | 210994 | 7 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||||
18324807 | 63242 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800668 | 63242 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL2105773 | 210994 | 7 | None | 1 | 2 | Rat | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||||
CHEMBL409018 | 210994 | 7 | None | 1 | 2 | Rat | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||||
44321964 | 95972 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL261979 | 95972 | 0 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
16156328 | 96204 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1592 | 43 | 16 | 17 | 3.4 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL263691 | 96204 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1592 | 43 | 16 | 17 | 3.4 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398047 | 96465 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL265879 | 96465 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16156328 | 96204 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1592 | 43 | 16 | 17 | 3.4 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL263691 | 96204 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1592 | 43 | 16 | 17 | 3.4 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL376654 | 210506 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
CHEMBL376654 | 210506 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
44398065 | 155172 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1671 | 41 | 17 | 18 | 2.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL405273 | 155172 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1671 | 41 | 17 | 18 | 2.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
11250647 | 1516 | 40 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
5293 | 1516 | 40 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
8362 | 1516 | 40 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
CHEMBL1208155 | 1516 | 40 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
DB11979 | 1516 | 40 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
44449120 | 94789 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL256109 | 94789 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL262747 | 208801 | 8 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||||
44380487 | 167018 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]ncc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL430069 | 167018 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]ncc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
23656390 | 161134 | 0 | None | -4 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL413245 | 161134 | 0 | None | -4 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL219562 | 207672 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=O)CNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL219562 | 207672 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=O)CNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
44398064 | 166457 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1647 | 40 | 17 | 20 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL428825 | 166457 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1647 | 40 | 17 | 20 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
145957953 | 161581 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 633 | 9 | 1 | 9 | 4.3 | COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4161566 | 161581 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 633 | 9 | 1 | 9 | 4.3 | COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
44398063 | 161260 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1661 | 41 | 17 | 20 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL414347 | 161260 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1661 | 41 | 17 | 20 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
58239302 | 161441 | 0 | None | 616 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4159247 | 161441 | 0 | None | 616 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44395462 | 167660 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL433594 | 167660 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
16155358 | 137608 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1778 | 49 | 18 | 21 | 1.9 | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL376728 | 137608 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1778 | 49 | 18 | 21 | 1.9 | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398043 | 161148 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1603 | 37 | 17 | 18 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL413450 | 161148 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1603 | 37 | 17 | 18 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16155358 | 137608 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1778 | 49 | 18 | 21 | 1.9 | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL376728 | 137608 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1778 | 49 | 18 | 21 | 1.9 | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
101755083 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050134t | ||||
16156341 | 161182 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1929 | 63 | 17 | 25 | 2.5 | CONC(=O)NCCOCCOCCOCCOCCOCCOCCC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL413688 | 161182 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1929 | 63 | 17 | 25 | 2.5 | CONC(=O)NCCOCCOCCOCCOCCOCCOCCC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16156341 | 161182 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1929 | 63 | 17 | 25 | 2.5 | CONC(=O)NCCOCCOCCOCCOCCOCCOCCC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL413688 | 161182 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1929 | 63 | 17 | 25 | 2.5 | CONC(=O)NCCOCCOCCOCCOCCOCCOCCC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)NOC)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16155098 | 160118 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1656 | 43 | 19 | 19 | 0.1 | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL411337 | 160118 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1656 | 43 | 19 | 19 | 0.1 | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16155098 | 160118 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1656 | 43 | 19 | 19 | 0.1 | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL411337 | 160118 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1656 | 43 | 19 | 19 | 0.1 | CONC(=O)NCC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16221267 | 141470 | 0 | None | -2 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL387499 | 141470 | 0 | None | -2 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
16221266 | 165806 | 0 | None | -2 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL427438 | 165806 | 0 | None | -2 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1564 | 41 | 14 | 17 | 3.7 | CS[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm0613931 | ||
44398150 | 96253 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1617 | 40 | 17 | 18 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL264090 | 96253 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1617 | 40 | 17 | 18 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44398066 | 96698 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1701 | 41 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCNC(C(=O)O)C1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL267873 | 96698 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1701 | 41 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCNC(C(=O)O)C1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44398045 | 161417 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1715 | 40 | 19 | 20 | -1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=O)[C@H]1CC(=O)NC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL415820 | 161417 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 1715 | 40 | 19 | 20 | -1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=O)[C@H]1CC(=O)NC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44293111 | 100748 | 0 | None | -5 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295917 | 100748 | 0 | None | -5 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44398151 | 161401 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 43 | 17 | 20 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL415595 | 161401 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 43 | 17 | 20 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44398046 | 160779 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N(C)[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL412500 | 160779 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N(C)[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
1185 | 3645 | 32 | None | -5 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | -5 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | -5 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | -5 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
44320921 | 106685 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 548 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL316362 | 106685 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 548 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44398135 | 96356 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1675 | 41 | 16 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CN(C)CCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL265020 | 96356 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1675 | 41 | 16 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CN(C)CCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44398001 | 168389 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1661 | 41 | 17 | 20 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CNCCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL438905 | 168389 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1661 | 41 | 17 | 20 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CNCCC(=O)OC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
10004181 | 100617 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL294910 | 100617 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44292974 | 100925 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 544 | 7 | 4 | 5 | 7.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL297238 | 100925 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 544 | 7 | 4 | 5 | 7.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44460342 | 167359 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 606 | 9 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL431402 | 167359 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 606 | 9 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
16656823 | 128141 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 468 | 5 | 2 | 6 | 4.3 | CC(C)(C(=O)c1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1)c1ccccc1 | nan | ||
CHEMBL3668011 | 128141 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 468 | 5 | 2 | 6 | 4.3 | CC(C)(C(=O)c1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1)c1ccccc1 | nan | ||
11191675 | 63052 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL179600 | 63052 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL3085404 | 63052 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
1185 | 3645 | 32 | None | -5 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
3038517 | 3645 | 32 | None | -5 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
CHEMBL22055 | 3645 | 32 | None | -5 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
DB06494 | 3645 | 32 | None | -5 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
44380317 | 167924 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL435262 | 167924 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44359191 | 12100 | 0 | None | 173 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184298 | 12100 | 0 | None | 173 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL343396 | 12100 | 0 | None | 173 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44398121 | 96185 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1655 | 41 | 18 | 19 | 0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
77232195 | 96185 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1655 | 41 | 18 | 19 | 0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL263507 | 96185 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1655 | 41 | 18 | 19 | 0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16145131 | 158933 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cc(O)nc(O)n3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361540 | 158933 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cc(O)nc(O)n3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL410165 | 158933 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cc(O)nc(O)n3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361888 | 141244 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL386105 | 141244 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL2369138 | 207852 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CNC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
44380222 | 57291 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 614 | 10 | 2 | 5 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166778 | 57291 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 614 | 10 | 2 | 5 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293010 | 173675 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 472 | 7 | 2 | 8 | 5.0 | O=[N+]([O-])c1cccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45490 | 173675 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 472 | 7 | 2 | 8 | 5.0 | O=[N+]([O-])c1cccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
1179 | 947 | 31 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
9957278 | 947 | 31 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
CHEMBL494803 | 947 | 31 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
44434414 | 88098 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 709 | 14 | 3 | 9 | 4.6 | C#CCNC(=O)CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCC)cc2)nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL235179 | 88098 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 709 | 14 | 3 | 9 | 4.6 | C#CCNC(=O)CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCC)cc2)nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12 | 10.1016/j.bmc.2007.04.065 | ||
44293594 | 101096 | 0 | None | -10 | 2 | Rat | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298497 | 101096 | 0 | None | -10 | 2 | Rat | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293349 | 183542 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48273 | 183542 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
145993478 | 166766 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 602 | 8 | 3 | 9 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1)C(=O)O | 10.1039/C7MD00320J | ||
CHEMBL4294163 | 166766 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 602 | 8 | 3 | 9 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1)C(=O)O | 10.1039/C7MD00320J | ||
44577102 | 177951 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 303 | 5 | 1 | 4 | 4.1 | CCSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1021/jm701249f | ||
CHEMBL466735 | 177951 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 303 | 5 | 1 | 4 | 4.1 | CCSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1021/jm701249f | ||
118098039 | 128135 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 461 | 4 | 1 | 6 | 3.5 | Cc1cccc(N(C)S(=O)(=O)c2ccc(Cl)c(-n3c(=O)[nH]c4sccc4c3=O)c2)c1 | nan | ||
CHEMBL3668005 | 128135 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 461 | 4 | 1 | 6 | 3.5 | Cc1cccc(N(C)S(=O)(=O)c2ccc(Cl)c(-n3c(=O)[nH]c4sccc4c3=O)c2)c1 | nan | ||
44380681 | 58466 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 669 | 9 | 3 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(F)(F)F)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168726 | 58466 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 669 | 9 | 3 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(F)(F)F)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44341198 | 112559 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 620 | 10 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL331144 | 112559 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 620 | 10 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
145959547 | 161733 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 604 | 9 | 1 | 9 | 3.9 | Cc1ccccc1C(N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4164102 | 161733 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 604 | 9 | 1 | 9 | 3.9 | Cc1ccccc1C(N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
44359191 | 12100 | 0 | None | -173 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184298 | 12100 | 0 | None | -173 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL343396 | 12100 | 0 | None | -173 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
11467552 | 172142 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL450471 | 172142 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44561397 | 189232 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL516479 | 189232 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44341197 | 108548 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 587 | 9 | 2 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C#N)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL321258 | 108548 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 587 | 9 | 2 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C#N)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44321394 | 106456 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 592 | 10 | 2 | 4 | 7.5 | COc1ccc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)cn1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL314860 | 106456 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 592 | 10 | 2 | 4 | 7.5 | COc1ccc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)cn1 | 10.1016/s0960-894x(01)00512-1 | ||
44395677 | 66405 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 565 | 7 | 2 | 8 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185738 | 66405 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 565 | 7 | 2 | 8 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44380538 | 58776 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 619 | 9 | 2 | 5 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169620 | 58776 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 619 | 9 | 2 | 5 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380318 | 119873 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL353308 | 119873 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293151 | 100705 | 0 | None | 23 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295595 | 100705 | 0 | None | 23 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
44432638 | 86357 | 0 | None | 10 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232151 | 86357 | 0 | None | 10 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44451397 | 95458 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 856 | 16 | 4 | 10 | 5.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL259220 | 95458 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 856 | 16 | 4 | 10 | 5.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44444665 | 93767 | 0 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249772 | 93767 | 0 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44432638 | 86357 | 0 | None | -10 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232151 | 86357 | 0 | None | -10 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
10208964 | 66349 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 536 | 7 | 2 | 7 | 7.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCC2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185438 | 66349 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 536 | 7 | 2 | 7 | 7.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCC2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44444676 | 154399 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401080 | 154399 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444628 | 93883 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250568 | 93883 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44340929 | 113003 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 604 | 10 | 2 | 4 | 7.7 | CC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL332049 | 113003 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 604 | 10 | 2 | 4 | 7.7 | CC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44293591 | 101125 | 0 | None | 1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298700 | 101125 | 0 | None | 1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44572286 | 180219 | 0 | None | -6 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475650 | 180219 | 0 | None | -6 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
11237922 | 65189 | 0 | None | 1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1021/jm701249f | ||
CHEMBL183066 | 65189 | 0 | None | 1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1021/jm701249f | ||
44293194 | 185853 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 602 | 14 | 3 | 4 | 6.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL48763 | 185853 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 602 | 14 | 3 | 4 | 6.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00274-8 | ||
44292919 | 100676 | 0 | None | -2 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295376 | 100676 | 0 | None | -2 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
25193798 | 169631 | 0 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL444509 | 169631 | 0 | None | 2 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44293802 | 101562 | 0 | None | -1 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL301802 | 101562 | 0 | None | -1 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293273 | 161543 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL416102 | 161543 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293164 | 167268 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 482 | 11 | 3 | 3 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL430763 | 167268 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 482 | 11 | 3 | 3 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44321496 | 105483 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 657 | 13 | 2 | 5 | 6.3 | CCS(=O)(=O)N1CCN(C(=O)C(C)(C)c2ccc3[nH]c(-c4cc(C)cc(C)c4)c([C@H](C)CNCCCCc4ccncc4)c3c2)CC1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL312995 | 105483 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 657 | 13 | 2 | 5 | 6.3 | CCS(=O)(=O)N1CCN(C(=O)C(C)(C)c2ccc3[nH]c(-c4cc(C)cc(C)c4)c([C@H](C)CNCCCCc4ccncc4)c3c2)CC1 | 10.1016/s0960-894x(01)00512-1 | ||
145980339 | 166034 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 380 | 4 | 1 | 3 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCF)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4280124 | 166034 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 380 | 4 | 1 | 3 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCF)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
44359333 | 11525 | 0 | None | -151 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180707 | 11525 | 0 | None | -151 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138999 | 11525 | 0 | None | -151 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44361524 | 168029 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1623 | 40 | 15 | 17 | 3.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL435925 | 168029 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1623 | 40 | 15 | 17 | 3.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
44444632 | 93884 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 622 | 7 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250569 | 93884 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 622 | 7 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
9895596 | 63185 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800152 | 63185 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
16221557 | 165463 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1546 | 41 | 15 | 17 | 1.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL425486 | 165463 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1546 | 41 | 15 | 17 | 1.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
44573276 | 186833 | 0 | None | 4 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493731 | 186833 | 0 | None | 4 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
44321100 | 106609 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC(CC5)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315909 | 106609 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC(CC5)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44380394 | 119443 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL349638 | 119443 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44398117 | 161416 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1649 | 43 | 19 | 19 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNc1ncc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL415813 | 161416 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 1649 | 43 | 19 | 19 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNc1ncc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44358957 | 12038 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184158 | 12038 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL336039 | 12038 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293070 | 165542 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL42592 | 165542 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
18914248 | 187148 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49542 | 187148 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293335 | 172058 | 0 | None | 1 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL449351 | 172058 | 0 | None | 1 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293195 | 184710 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48592 | 184710 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44293165 | 101223 | 0 | None | -7 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299392 | 101223 | 0 | None | -7 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44380212 | 57313 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166843 | 57313 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44434437 | 150441 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 1663 | 42 | 6 | 27 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL395826 | 150441 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 1663 | 42 | 6 | 27 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44359254 | 11527 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180716 | 11527 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139292 | 11527 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
44434412 | 161228 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 1565 | 39 | 4 | 26 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL414045 | 161228 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 1565 | 39 | 4 | 26 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44572236 | 171333 | 0 | None | 6 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL446978 | 171333 | 0 | None | 6 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
11496945 | 175901 | 0 | None | 17 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459659 | 175901 | 0 | None | 17 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
24825725 | 192027 | 0 | None | 7 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL521674 | 192027 | 0 | None | 7 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44321510 | 106655 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 608 | 15 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL316159 | 106655 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 608 | 15 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
9983568 | 98525 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL279885 | 98525 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
44215053 | 185038 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48641 | 185038 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44359285 | 11522 | 0 | None | 17 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180695 | 11522 | 0 | None | 17 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138747 | 11522 | 0 | None | 17 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44572287 | 180221 | 0 | None | 9 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475660 | 180221 | 0 | None | 9 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44292990 | 100728 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCN(CCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295731 | 100728 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCN(CCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293348 | 100026 | 0 | None | 1 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL290991 | 100026 | 0 | None | 1 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293487 | 101163 | 0 | None | -2 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299006 | 101163 | 0 | None | -2 | 2 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
9936150 | 188150 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50500 | 188150 | 0 | None | - | 1 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
145952400 | 162185 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(CC(N)c2ccccc2F)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4171296 | 162185 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(CC(N)c2ccccc2F)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
145950534 | 162255 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(CC(N)c2cccc(F)c2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4172405 | 162255 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(CC(N)c2cccc(F)c2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
44293605 | 100704 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295591 | 100704 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
10209293 | 100732 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295791 | 100732 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
24825725 | 192027 | 0 | None | 7 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL521674 | 192027 | 0 | None | 7 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
12283 | 2292 | 12 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | nan | ||
16656889 | 2292 | 12 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | nan | ||
CHEMBL3668014 | 2292 | 12 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | nan | ||
16656891 | 128144 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 522 | 9 | 2 | 8 | 3.5 | COCCOc1ccc(F)c(F)c1COc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
CHEMBL3668015 | 128144 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 522 | 9 | 2 | 8 | 3.5 | COCCOc1ccc(F)c(F)c1COc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
10438167 | 100712 | 0 | None | 15 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295641 | 100712 | 0 | None | 15 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293803 | 188295 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50721 | 188295 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
20691661 | 79203 | 0 | None | 138 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211485 | 79203 | 0 | None | 138 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
145953549 | 161867 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 619 | 8 | 2 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4166067 | 161867 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 619 | 8 | 2 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
44293054 | 101025 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297927 | 101025 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292919 | 100676 | 0 | None | 2 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295376 | 100676 | 0 | None | 2 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
15602808 | 8025 | 0 | None | -5 | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091580 | 8025 | 0 | None | -5 | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44561368 | 176240 | 0 | None | -42 | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460892 | 176240 | 0 | None | -42 | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44434435 | 88134 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 1575 | 36 | 6 | 25 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL235361 | 88134 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 1575 | 36 | 6 | 25 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44572286 | 180219 | 0 | None | 6 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475650 | 180219 | 0 | None | 6 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44293222 | 175387 | 0 | None | 100 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138464 | 175387 | 0 | None | 100 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL45883 | 175387 | 0 | None | 100 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
9958318 | 89796 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23830 | 89796 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44293348 | 100026 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL290991 | 100026 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44432653 | 86277 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231761 | 86277 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44380146 | 119771 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 627 | 10 | 2 | 4 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352565 | 119771 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 627 | 10 | 2 | 4 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293062 | 186125 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)cc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48853 | 186125 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)cc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44577104 | 178169 | 0 | None | -7 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL468565 | 178169 | 0 | None | -7 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
145973813 | 162473 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 604 | 9 | 1 | 9 | 3.9 | Cc1cccc(C(N)Cn2c(=O)c(N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4175816 | 162473 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 604 | 9 | 1 | 9 | 3.9 | Cc1cccc(C(N)Cn2c(=O)c(N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
44293053 | 101022 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297918 | 101022 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293803 | 188295 | 0 | None | -1 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50721 | 188295 | 0 | None | -1 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293651 | 162564 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417726 | 162564 | 0 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44432656 | 158612 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 645 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL409825 | 158612 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 645 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44444641 | 154430 | 0 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401212 | 154430 | 0 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143420 | 162358 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173938 | 162358 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
44359458 | 12041 | 0 | None | -15 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184171 | 12041 | 0 | None | -15 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL336884 | 12041 | 0 | None | -15 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
145955260 | 161984 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccc(F)cc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4167957 | 161984 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 608 | 9 | 1 | 9 | 3.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccc(F)cc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
16656887 | 128142 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 504 | 6 | 2 | 7 | 4.8 | COc1ccc(F)cc1C(C)(C)Sc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
CHEMBL3668012 | 128142 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 504 | 6 | 2 | 7 | 4.8 | COc1ccc(F)cc1C(C)(C)Sc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
44380551 | 58450 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168649 | 58450 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
145955571 | 162109 | 0 | None | -131 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169891 | 162109 | 0 | None | -131 | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
44293555 | 100740 | 0 | None | -141 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 574 | 11 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C4(C(=O)N5C6CCC5CC6)CCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295897 | 100740 | 0 | None | -141 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 574 | 11 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C4(C(=O)N5C6CCC5CC6)CCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44444649 | 154466 | 0 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401418 | 154466 | 0 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44398149 | 160747 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 1621 | 40 | 18 | 19 | 0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL412212 | 160747 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 1621 | 40 | 18 | 19 | 0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44293041 | 100870 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296819 | 100870 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
44292833 | 101070 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 480 | 7 | 2 | 7 | 5.5 | Cc1cc(CC#N)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL298278 | 101070 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 480 | 7 | 2 | 7 | 5.5 | Cc1cc(CC#N)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44292733 | 176209 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 548 | 7 | 4 | 5 | 6.8 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46060 | 176209 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 548 | 7 | 4 | 5 | 6.8 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
10348973 | 3261 | 50 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
44577104 | 178169 | 0 | None | 7 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL468565 | 178169 | 0 | None | 7 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44293249 | 184861 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL48616 | 184861 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
10077523 | 122199 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL360429 | 122199 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44395463 | 126254 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 627 | 7 | 2 | 7 | 7.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL365366 | 126254 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 627 | 7 | 2 | 7 | 7.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44215055 | 100820 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296442 | 100820 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293249 | 184861 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48616 | 184861 | 0 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
21899433 | 154164 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399772 | 154164 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44341081 | 167501 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 590 | 10 | 2 | 3 | 8.0 | CCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL432450 | 167501 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 590 | 10 | 2 | 3 | 8.0 | CCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
16656822 | 128140 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 455 | 4 | 2 | 6 | 3.4 | CN(C(=O)c1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1)c1ccccc1 | nan | ||
CHEMBL3668010 | 128140 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 455 | 4 | 2 | 6 | 3.4 | CN(C(=O)c1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1)c1ccccc1 | nan | ||
44359333 | 11525 | 0 | None | 151 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180707 | 11525 | 0 | None | 151 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138999 | 11525 | 0 | None | 151 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293347 | 162561 | 0 | None | 4 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417720 | 162561 | 0 | None | 4 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293592 | 162340 | 0 | None | -4 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417363 | 162340 | 0 | None | -4 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44434434 | 147541 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1531 | 33 | 6 | 24 | 8.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL393486 | 147541 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1531 | 33 | 6 | 24 | 8.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44434392 | 168432 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1389 | 27 | 4 | 22 | 9.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL439200 | 168432 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1389 | 27 | 4 | 22 | 9.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44444652 | 94066 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251578 | 94066 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44293111 | 100748 | 0 | None | -5 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295917 | 100748 | 0 | None | -5 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44444642 | 93934 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250770 | 93934 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
58022100 | 128133 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 473 | 3 | 1 | 6 | 3.5 | O=c1[nH]c2ccsc2c(=O)n1-c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl | nan | ||
CHEMBL3668003 | 128133 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 473 | 3 | 1 | 6 | 3.5 | O=c1[nH]c2ccsc2c(=O)n1-c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl | nan | ||
138978203 | 166147 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 639 | 7 | 3 | 11 | 3.1 | Cc1cn([C@H]2C[C@@H](n3cc(CN4CCN(c5cccc6[nH]c(-c7ccc(C(C)(C)C)cc7)nc56)CC4)nn3)[C@@H](CO)O2)c(=O)[nH]c1=O | 10.1039/C7MD00320J | ||
CHEMBL4282476 | 166147 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 639 | 7 | 3 | 11 | 3.1 | Cc1cn([C@H]2C[C@@H](n3cc(CN4CCN(c5cccc6[nH]c(-c7ccc(C(C)(C)C)cc7)nc56)CC4)nn3)[C@@H](CO)O2)c(=O)[nH]c1=O | 10.1039/C7MD00320J | ||
145984647 | 165863 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 509 | 5 | 1 | 6 | 5.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6ccc(F)cc6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4277116 | 165863 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 509 | 5 | 1 | 6 | 5.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6ccc(F)cc6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
138978207 | 166600 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | C#CCN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1039/C7MD00320J | ||
CHEMBL4290761 | 166600 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | C#CCN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1039/C7MD00320J | ||
16657781 | 128136 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 517 | 4 | 2 | 7 | 3.2 | O=C(O)c1scc2[nH]c(=O)n(-c3cc(S(=O)(=O)N4CCCc5ccccc54)ccc3Cl)c(=O)c12 | nan | ||
CHEMBL3668006 | 128136 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 517 | 4 | 2 | 7 | 3.2 | O=C(O)c1scc2[nH]c(=O)n(-c3cc(S(=O)(=O)N4CCCc5ccccc54)ccc3Cl)c(=O)c12 | nan | ||
44380798 | 59014 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 588 | 9 | 3 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170606 | 59014 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 588 | 9 | 3 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380537 | 96113 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL263004 | 96113 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL2371821 | 208384 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CN[C@H](C(=O)O)C1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||||
CHEMBL438629 | 212035 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NCCOCCOCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL438629 | 212035 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NCCOCCOCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL2371822 | 208385 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | None | None | None | C#C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||||
16156049 | 96335 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 44 | 17 | 19 | 2.5 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL264781 | 96335 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 44 | 17 | 19 | 2.5 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16156049 | 96335 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 44 | 17 | 19 | 2.5 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL264781 | 96335 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1689 | 44 | 17 | 19 | 2.5 | CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
102090748 | 161258 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
16138575 | 161258 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL414344 | 161258 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
44395491 | 123332 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL362544 | 123332 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
10053165 | 183417 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL48192 | 183417 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44398044 | 154692 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1617 | 38 | 17 | 18 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL402683 | 154692 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 1617 | 38 | 17 | 18 | 0.3 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16221433 | 141631 | 0 | None | -1 | 2 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL388369 | 141631 | 0 | None | -1 | 2 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
16221494 | 161403 | 0 | None | -8 | 2 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL415659 | 161403 | 0 | None | -8 | 2 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
9873212 | 57272 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 588 | 9 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166649 | 57272 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 588 | 9 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
10008768 | 58426 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168563 | 58426 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL268450 | 209010 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@H](Cc2ccc(NC(=O)NCCOCCOCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL268450 | 209010 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@H](Cc2ccc(NC(=O)NCCOCCOCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
11365653 | 173618 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL454774 | 173618 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44448991 | 154802 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
44320895 | 163710 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL421160 | 163710 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44380626 | 58419 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 587 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168539 | 58419 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 587 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
16155654 | 165525 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1642 | 42 | 20 | 19 | -0.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CCNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL425813 | 165525 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1642 | 42 | 20 | 19 | -0.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CCNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16155654 | 165525 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1642 | 42 | 20 | 19 | -0.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CCNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL425813 | 165525 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1642 | 42 | 20 | 19 | -0.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CCNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398178 | 161280 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1660 | 43 | 18 | 19 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNCc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL414507 | 161280 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1660 | 43 | 18 | 19 | 1.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNCc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44361795 | 167933 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1574 | 40 | 15 | 18 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL435322 | 167933 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 1574 | 40 | 15 | 18 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL269711 | 209056 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
21036877 | 173078 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL453441 | 173078 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
11167850 | 2701 | 22 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1178 | 2701 | 22 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1187 | 2701 | 22 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
CHEMBL179691 | 2701 | 22 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
44321101 | 96400 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL265288 | 96400 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
9960399 | 50271 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 603 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3nnnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL157412 | 50271 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 603 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3nnnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44398040 | 168246 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1681 | 41 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL437672 | 168246 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1681 | 41 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL264779 | 208885 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL268813 | 209020 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
CHEMBL264779 | 208885 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CONC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NOC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
CHEMBL268813 | 209020 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||||
44293195 | 184710 | 0 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48592 | 184710 | 0 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
15602804 | 7998 | 0 | None | 70 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091209 | 7998 | 0 | None | 70 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44340928 | 9652 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 606 | 10 | 3 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL113432 | 9652 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 606 | 10 | 3 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
16656888 | 128143 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 488 | 5 | 2 | 7 | 3.3 | CC(C)(c1ccccc1)S(=O)(=O)c1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
CHEMBL3668013 | 128143 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 488 | 5 | 2 | 7 | 3.3 | CC(C)(c1ccccc1)S(=O)(=O)c1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
44293058 | 101523 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 483 | 6 | 2 | 6 | 6.4 | CC(C)(C)c1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL301552 | 101523 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 483 | 6 | 2 | 6 | 6.4 | CC(C)(C)c1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1 | 10.1016/s0960-894x(00)00318-8 | ||
24825725 | 192027 | 0 | None | -7 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL521674 | 192027 | 0 | None | -7 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
44293484 | 96268 | 0 | None | -64 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 604 | 12 | 1 | 3 | 8.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)C(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL264193 | 96268 | 0 | None | -64 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 604 | 12 | 1 | 3 | 8.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)C(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
44214069 | 100848 | 0 | None | - | 1 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 575 | 14 | 3 | 5 | 6.1 | CCOC(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL296644 | 100848 | 0 | None | - | 1 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 575 | 14 | 3 | 5 | 6.1 | CCOC(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
16221614 | 136025 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1562 | 41 | 15 | 18 | 0.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)S(=O)(=O)C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL373725 | 136025 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 1562 | 41 | 15 | 18 | 0.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)S(=O)(=O)C(C)C)cc1 | 10.1021/jm0613931 | ||
44432646 | 146701 | 0 | None | 2 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392843 | 146701 | 0 | None | 2 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44444639 | 154428 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401193 | 154428 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44321498 | 204582 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87099 | 204582 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44359471 | 12092 | 0 | None | 67 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184266 | 12092 | 0 | None | 67 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341717 | 12092 | 0 | None | 67 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44444672 | 168836 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL442283 | 168836 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
44293074 | 187200 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49578 | 187200 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44561108 | 185848 | 0 | None | 4 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL487627 | 185848 | 0 | None | 4 | 2 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44444670 | 94043 | 0 | None | -6 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251388 | 94043 | 0 | None | -6 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444673 | 93847 | 0 | None | -2 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250389 | 93847 | 0 | None | -2 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
145954439 | 162106 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 622 | 9 | 1 | 9 | 4.0 | Cc1cc(F)cc([C@@H](N)Cn2c(=O)c(N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169864 | 162106 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 622 | 9 | 1 | 9 | 4.0 | Cc1cc(F)cc([C@@H](N)Cn2c(=O)c(N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
44341046 | 9981 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 634 | 11 | 2 | 5 | 7.5 | CC(=O)OCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL115365 | 9981 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 634 | 11 | 2 | 5 | 7.5 | CC(=O)OCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44359301 | 11531 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180754 | 11531 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141221 | 11531 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293488 | 101084 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298366 | 101084 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293335 | 172058 | 0 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL449351 | 172058 | 0 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44432657 | 148935 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 635 | 10 | 3 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(C(=O)O)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL394613 | 148935 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 635 | 10 | 3 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(C(=O)O)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44398396 | 161374 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 1737 | 44 | 17 | 20 | 2.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCN(c1ccccn1)c1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL415328 | 161374 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 1737 | 44 | 17 | 20 | 2.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCN(c1ccccn1)c1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
9845762 | 186244 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 433 | 6 | 2 | 7 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccs3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48938 | 186244 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 433 | 6 | 2 | 7 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccs3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44444675 | 154184 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399857 | 154184 | 0 | None | -3 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44321497 | 97642 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 665 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL273390 | 97642 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 665 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44293076 | 101351 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 600 | 12 | 3 | 4 | 6.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL300268 | 101351 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 600 | 12 | 3 | 4 | 6.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293222 | 175387 | 0 | None | -100 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138464 | 175387 | 0 | None | -100 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL45883 | 175387 | 0 | None | -100 | 2 | Rat | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293126 | 161766 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 2 | 7 | 5.8 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)s3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL416459 | 161766 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 2 | 7 | 5.8 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)s3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44292747 | 187357 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 494 | 7 | 4 | 5 | 5.8 | Cc1cccc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49695 | 187357 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 494 | 7 | 4 | 5 | 5.8 | Cc1cccc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44587394 | 171906 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 599 | 11 | 2 | 7 | 5.1 | Cc1c(-c2cccc(OCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL448253 | 171906 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 599 | 11 | 2 | 7 | 5.1 | Cc1c(-c2cccc(OCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44573110 | 186611 | 0 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492327 | 186611 | 0 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
71449058 | 83985 | 0 | None | -10 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111955 | 83985 | 0 | None | -10 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2219718 | 83985 | 0 | None | -10 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
25193700 | 172711 | 0 | None | 7 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452547 | 172711 | 0 | None | 7 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44293163 | 188115 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50433 | 188115 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44444668 | 153745 | 0 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL398648 | 153745 | 0 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44434389 | 168338 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 838 | 21 | 2 | 14 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL438504 | 168338 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 838 | 21 | 2 | 14 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44292661 | 101319 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 495 | 6 | 2 | 6 | 6.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL300048 | 101319 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 495 | 6 | 2 | 6 | 6.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44561369 | 189874 | 0 | None | 15 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL517881 | 189874 | 0 | None | 15 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44341082 | 9685 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 590 | 9 | 2 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)nc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL113574 | 9685 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 590 | 9 | 2 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)nc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
11620431 | 178789 | 0 | None | -21 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL473807 | 178789 | 0 | None | -21 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
11496945 | 175901 | 0 | None | -17 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459659 | 175901 | 0 | None | -17 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
10258659 | 12093 | 0 | None | -46 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184268 | 12093 | 0 | None | -46 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341809 | 12093 | 0 | None | -46 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293208 | 170577 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL445848 | 170577 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292940 | 100794 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296244 | 100794 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293511 | 100816 | 0 | None | 3 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296426 | 100816 | 0 | None | 3 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293377 | 101433 | 0 | None | 2 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300865 | 101433 | 0 | None | 2 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293236 | 174307 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 560 | 13 | 4 | 4 | 5.7 | CCNC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45639 | 174307 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 560 | 13 | 4 | 4 | 5.7 | CCNC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
54584354 | 60926 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 515 | 7 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2cnc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@H]2CCCCN2)c1 | 10.1021/jm101501b | ||
CHEMBL1766108 | 60926 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 515 | 7 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2cnc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@H]2CCCCN2)c1 | 10.1021/jm101501b | ||
44293112 | 186712 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cncnc4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49293 | 186712 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cncnc4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
16221434 | 96739 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
CHEMBL268297 | 96739 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 1548 | 40 | 13 | 16 | 4.7 | CS[C@@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(C)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0613931 | ||
44593424 | 175559 | 0 | None | -4 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL459215 | 175559 | 0 | None | -4 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44593424 | 175559 | 0 | None | -4 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459215 | 175559 | 0 | None | -4 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44341199 | 112560 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 620 | 10 | 2 | 5 | 7.2 | COC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL331145 | 112560 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 620 | 10 | 2 | 5 | 7.2 | COC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44398119 | 96810 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 1646 | 41 | 18 | 19 | -0.4 | CNC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL268829 | 96810 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 1646 | 41 | 18 | 19 | -0.4 | CNC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44359252 | 11526 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180715 | 11526 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139291 | 11526 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44432628 | 87327 | 0 | None | 13 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233762 | 87327 | 0 | None | 13 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44448991 | 154802 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
44293223 | 173729 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 545 | 8 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(CC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45501 | 173729 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 545 | 8 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(CC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44434387 | 152243 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 750 | 15 | 2 | 12 | 5.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL397360 | 152243 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 750 | 15 | 2 | 12 | 5.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44587393 | 172065 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 613 | 12 | 2 | 7 | 5.5 | Cc1c(-c2cccc(OCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL449468 | 172065 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 613 | 12 | 2 | 7 | 5.5 | Cc1c(-c2cccc(OCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44341164 | 9473 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL112378 | 9473 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44432651 | 86276 | 0 | None | -21 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231760 | 86276 | 0 | None | -21 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
15602805 | 8023 | 0 | None | -11 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091579 | 8023 | 0 | None | -11 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
44293376 | 101205 | 0 | None | 1 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299301 | 101205 | 0 | None | 1 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293594 | 101096 | 0 | None | 10 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298497 | 101096 | 0 | None | 10 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293131 | 188252 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 520 | 10 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50663 | 188252 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 520 | 10 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293650 | 161779 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL416470 | 161779 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44432641 | 166942 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 540 | 9 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2Cl)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL429976 | 166942 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 540 | 9 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2Cl)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44292878 | 174398 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 441 | 6 | 2 | 6 | 5.4 | Cc1cccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45661 | 174398 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 441 | 6 | 2 | 6 | 5.4 | Cc1cccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
25156400 | 188272 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 581 | 12 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL506877 | 188272 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 581 | 12 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
11214860 | 84347 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
CHEMBL22314 | 84347 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
44380483 | 58766 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 635 | 9 | 4 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2F)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169569 | 58766 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 635 | 9 | 4 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2F)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44292835 | 180673 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 526 | 10 | 2 | 7 | 6.2 | CCN(CC)Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL47618 | 180673 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 526 | 10 | 2 | 7 | 6.2 | CCN(CC)Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
1185 | 3645 | 32 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
18914272 | 169114 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL443768 | 169114 | 0 | None | - | 1 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44432640 | 154434 | 0 | None | 1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL401226 | 154434 | 0 | None | 1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
16656819 | 128138 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 530 | 4 | 2 | 7 | 2.9 | CNC(=O)c1scc2[nH]c(=O)n(-c3cc(S(=O)(=O)N4CCCc5ccccc54)ccc3Cl)c(=O)c12 | nan | ||
CHEMBL3668008 | 128138 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 530 | 4 | 2 | 7 | 2.9 | CNC(=O)c1scc2[nH]c(=O)n(-c3cc(S(=O)(=O)N4CCCc5ccccc54)ccc3Cl)c(=O)c12 | nan | ||
145949496 | 162308 | 0 | None | -165 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173065 | 162308 | 0 | None | -165 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
11496610 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
5582 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
CHEMBL474991 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
11496610 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
5582 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL474991 | 4012 | 11 | None | 8 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
44432653 | 86277 | 0 | None | -1 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231761 | 86277 | 0 | None | -1 | 2 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44444647 | 154462 | 0 | None | -1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401352 | 154462 | 0 | None | -1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
44432640 | 154434 | 0 | None | -1 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL401226 | 154434 | 0 | None | -1 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
25194090 | 188341 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 484 | 6 | 3 | 5 | 5.3 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL507973 | 188341 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 484 | 6 | 3 | 5 | 5.3 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44292983 | 100766 | 0 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 495 | 6 | 2 | 6 | 6.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296084 | 100766 | 0 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 495 | 6 | 2 | 6 | 6.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44444635 | 154166 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399779 | 154166 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
16656821 | 128139 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 474 | 6 | 2 | 7 | 3.9 | COc1cccc(F)c1C(C)Oc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
CHEMBL3668009 | 128139 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 474 | 6 | 2 | 7 | 3.9 | COc1cccc(F)c1C(C)Oc1ccc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
16656892 | 128146 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 491 | 6 | 2 | 7 | 3.5 | COc1cc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)cc1CN(C)c1c(F)cccc1F | nan | ||
CHEMBL3668017 | 128146 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 491 | 6 | 2 | 7 | 3.5 | COc1cc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)cc1CN(C)c1c(F)cccc1F | nan | ||
44293305 | 100991 | 0 | None | 1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL297703 | 100991 | 0 | None | 1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
10032223 | 12097 | 0 | None | -81 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184284 | 12097 | 0 | None | -81 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342822 | 12097 | 0 | None | -81 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
16146022 | 169552 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1631 | 41 | 17 | 18 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL444381 | 169552 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1631 | 41 | 17 | 18 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
9918188 | 154183 | 0 | None | 1 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399856 | 154183 | 0 | None | 1 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444626 | 154344 | 0 | None | -1 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400739 | 154344 | 0 | None | -1 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
16221212 | 165778 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL427269 | 165778 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
145954419 | 162079 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 651 | 9 | 1 | 9 | 4.4 | COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169486 | 162079 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 651 | 9 | 1 | 9 | 4.4 | COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
16156517 | 160180 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1642 | 42 | 19 | 19 | -0.3 | CONC(=O)NC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL411381 | 160180 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1642 | 42 | 19 | 19 | -0.3 | CONC(=O)NC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL219532 | 207671 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
16156517 | 160180 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1642 | 42 | 19 | 19 | -0.3 | CONC(=O)NC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL411381 | 160180 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1642 | 42 | 19 | 19 | -0.3 | CONC(=O)NC[C@@H](NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL219532 | 207671 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCOCCOCCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||||
54582417 | 60924 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 488 | 6 | 2 | 5 | 5.8 | Cc1cc(C)cc(-c2c(OCCC3CCCCN3)c3cc(-c4ccncn4)c(Cl)cc3[nH]c2=O)c1 | 10.1021/jm101501b | ||
CHEMBL1766106 | 60924 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 488 | 6 | 2 | 5 | 5.8 | Cc1cc(C)cc(-c2c(OCCC3CCCCN3)c3cc(-c4ccncn4)c(Cl)cc3[nH]c2=O)c1 | 10.1021/jm101501b | ||
25156943 | 187853 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 597 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL502341 | 187853 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 597 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
16221211 | 168696 | 0 | None | -2 | 2 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL441211 | 168696 | 0 | None | -2 | 2 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1566 | 40 | 14 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL2370890 | 208200 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
44449681 | 95599 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL259906 | 95599 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
9872676 | 77826 | 0 | None | 2 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
CHEMBL210514 | 77826 | 0 | None | 2 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
9893269 | 65964 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 532 | 7 | 2 | 7 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL184819 | 65964 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 532 | 7 | 2 | 7 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
16155218 | 166269 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1628 | 41 | 20 | 19 | -0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL428484 | 166269 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1628 | 41 | 20 | 19 | -0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16155218 | 166269 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1628 | 41 | 20 | 19 | -0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL428484 | 166269 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1628 | 41 | 20 | 19 | -0.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](CNC(=O)NO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398182 | 161397 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1635 | 42 | 19 | 19 | 0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNc1ncc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL415549 | 161397 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 1635 | 42 | 19 | 19 | 0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNc1ncc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
1188 | 217 | 40 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16131215 | 217 | 40 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
35 | 217 | 40 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL1252 | 217 | 40 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB00106 | 217 | 40 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL1251 | 206919 | 21 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | CC/N=C(\NCC)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCN/C(=N/CC)NCC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
44398179 | 161259 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1674 | 44 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNCc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL414346 | 161259 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1674 | 44 | 18 | 19 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNCc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44321963 | 105461 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 622 | 11 | 2 | 5 | 6.8 | COCn1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccc1=O | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL312864 | 105461 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 622 | 11 | 2 | 5 | 6.8 | COCn1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccc1=O | 10.1016/s0960-894x(01)00512-1 | ||
44380536 | 119885 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 602 | 9 | 2 | 4 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL353395 | 119885 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 602 | 9 | 2 | 4 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293378 | 101423 | 0 | None | -37 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 618 | 13 | 1 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)CC(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300792 | 101423 | 0 | None | -37 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 618 | 13 | 1 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)CC(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
10985312 | 78336 | 0 | None | 91 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21126 | 78336 | 0 | None | 91 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44434390 | 151111 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 882 | 24 | 2 | 15 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL396385 | 151111 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 882 | 24 | 2 | 15 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44434438 | 145662 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 1707 | 45 | 6 | 28 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392008 | 145662 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 1707 | 45 | 6 | 28 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44321458 | 105485 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 658 | 11 | 2 | 3 | 9.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCCC5C5CCCCC54)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313004 | 105485 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 658 | 11 | 2 | 3 | 9.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCCC5C5CCCCC54)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44380192 | 57146 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165534 | 57146 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44434402 | 146218 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 1433 | 30 | 4 | 23 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392433 | 146218 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 1433 | 30 | 4 | 23 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
145958075 | 161762 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 638 | 10 | 1 | 10 | 3.7 | COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4164522 | 161762 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 638 | 10 | 1 | 10 | 3.7 | COc1ccc(F)cc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
10258643 | 100913 | 0 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 644 | 16 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297151 | 100913 | 0 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 644 | 16 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44395502 | 165345 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 553 | 7 | 3 | 9 | 5.0 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2COCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL424991 | 165345 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 553 | 7 | 3 | 9 | 5.0 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2COCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44432647 | 86313 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 622 | 9 | 2 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(=O)n(C)c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231954 | 86313 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 622 | 9 | 2 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(=O)n(C)c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11496610 | 4012 | 11 | None | -8 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
5582 | 4012 | 11 | None | -8 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
CHEMBL474991 | 4012 | 11 | None | -8 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
44292838 | 101047 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298074 | 101047 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44359264 | 11523 | 0 | None | 11 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180700 | 11523 | 0 | None | 11 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138866 | 11523 | 0 | None | 11 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44292974 | 100925 | 0 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 544 | 7 | 4 | 5 | 7.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL297238 | 100925 | 0 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 544 | 7 | 4 | 5 | 7.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44380796 | 58891 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 598 | 9 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170159 | 58891 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 598 | 9 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293804 | 101329 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300095 | 101329 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44214098 | 100824 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296483 | 100824 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
15602807 | 8136 | 0 | None | -8 | 2 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092245 | 8136 | 0 | None | -8 | 2 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44561141 | 192897 | 0 | None | 37 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL527422 | 192897 | 0 | None | 37 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44577069 | 178139 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccccc3OC)ccc2n1Cc1ccccc1 | 10.1021/jm701249f | ||
CHEMBL468348 | 178139 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccccc3OC)ccc2n1Cc1ccccc1 | 10.1021/jm701249f | ||
44432628 | 87327 | 0 | None | -13 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233762 | 87327 | 0 | None | -13 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
10649568 | 14397 | 0 | None | 4 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 4 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
44293130 | 181310 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 482 | 11 | 3 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(N)=O)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL47791 | 181310 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 482 | 11 | 3 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(N)=O)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44434411 | 146220 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 1521 | 36 | 4 | 25 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392434 | 146220 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 1521 | 36 | 4 | 25 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44444678 | 154400 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401081 | 154400 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
44293085 | 97863 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccccc3Cl)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL274952 | 97863 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccccc3Cl)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
11496610 | 4012 | 11 | None | -8 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
5582 | 4012 | 11 | None | -8 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL474991 | 4012 | 11 | None | -8 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
44359456 | 12098 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184286 | 12098 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342908 | 12098 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293617 | 188090 | 0 | None | -23 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50380 | 188090 | 0 | None | -23 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293134 | 186818 | 0 | None | 1 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49366 | 186818 | 0 | None | 1 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44434388 | 89374 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 794 | 18 | 2 | 13 | 5.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL237729 | 89374 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 794 | 18 | 2 | 13 | 5.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44341186 | 9949 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 606 | 10 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(=O)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL115192 | 9949 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 606 | 10 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(=O)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
22129998 | 100805 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296321 | 100805 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
11477970 | 89069 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23729 | 89069 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
44293377 | 101433 | 0 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300865 | 101433 | 0 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293802 | 101562 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL301802 | 101562 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
145957253 | 161645 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 737 | 14 | 2 | 10 | 4.9 | COc1ccc(F)cc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(=O)O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4162619 | 161645 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 737 | 14 | 2 | 10 | 4.9 | COc1ccc(F)cc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(=O)O | 10.1016/j.ejmech.2017.12.095 | ||
44292888 | 174206 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 567 | 14 | 3 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45614 | 174206 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 567 | 14 | 3 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292918 | 170849 | 0 | None | 1 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL44627 | 170849 | 0 | None | 1 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44215908 | 93794 | 0 | None | -4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249982 | 93794 | 0 | None | -4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
16221329 | 136024 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1562 | 41 | 15 | 18 | 0.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)S(=O)(=O)C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL373724 | 136024 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1562 | 41 | 15 | 18 | 0.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)S(=O)(=O)C(C)C)cc1 | 10.1021/jm0613931 | ||
44449120 | 94789 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL256109 | 94789 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
16221613 | 166441 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 1530 | 41 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL428795 | 166441 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 1530 | 41 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
15602808 | 8025 | 0 | None | 5 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091580 | 8025 | 0 | None | 5 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44321146 | 105924 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 592 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC(C)(C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313946 | 105924 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 592 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC(C)(C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44593425 | 176191 | 0 | None | 12 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460480 | 176191 | 0 | None | 12 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
44593425 | 176191 | 0 | None | 12 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL460480 | 176191 | 0 | None | 12 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
44321410 | 106525 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315325 | 106525 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321393 | 204547 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 606 | 9 | 2 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)c(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86911 | 204547 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 606 | 9 | 2 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)c(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11226531 | 99059 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL283381 | 99059 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
10985312 | 78336 | 0 | None | 91 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21126 | 78336 | 0 | None | 91 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
16156639 | 137484 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1648 | 47 | 16 | 17 | 5.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL376466 | 137484 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1648 | 47 | 16 | 17 | 5.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16156639 | 137484 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1648 | 47 | 16 | 17 | 5.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL376466 | 137484 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1648 | 47 | 16 | 17 | 5.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
1190 | 869 | 41 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
583 | 869 | 41 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
44398180 | 155486 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1696 | 42 | 18 | 19 | 2.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNc1ccc2ccccc2n1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL406225 | 155486 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1696 | 42 | 18 | 19 | 2.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CNc1ccc2ccccc2n1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16147767 | 96910 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL269516 | 96910 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16221104 | 85133 | 0 | None | -6 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)Sc2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL227861 | 85133 | 0 | None | -6 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 1550 | 40 | 14 | 17 | 3.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)Sc2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
44380625 | 58418 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168538 | 58418 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9894997 | 119808 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352806 | 119808 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
16155412 | 160618 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1864 | 55 | 18 | 22 | 2.4 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL411749 | 160618 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1864 | 55 | 18 | 22 | 2.4 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16155412 | 160618 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1864 | 55 | 18 | 22 | 2.4 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
CHEMBL411749 | 160618 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1864 | 55 | 18 | 22 | 2.4 | CCOCCOCCNC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)NCCOCCOCC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm060240a | ||
16221150 | 161386 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1564 | 40 | 13 | 16 | 3.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)[S+](C)[O-])C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL415432 | 161386 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1564 | 40 | 13 | 16 | 3.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)[S+](C)[O-])C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
9938925 | 57287 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 616 | 11 | 3 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166763 | 57287 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 616 | 11 | 3 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380478 | 58447 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168637 | 58447 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
145955571 | 162109 | 0 | None | 131 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169891 | 162109 | 0 | None | 131 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
11331001 | 188435 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
16156572 | 166560 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1678 | 48 | 16 | 18 | 5.2 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL429016 | 166560 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1678 | 48 | 16 | 18 | 5.2 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
22130002 | 176128 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 505 | 6 | 2 | 6 | 5.8 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(Br)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45990 | 176128 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 505 | 6 | 2 | 6 | 5.8 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(Br)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44292829 | 176305 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 471 | 7 | 2 | 7 | 5.4 | COc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46157 | 176305 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 471 | 7 | 2 | 7 | 5.4 | COc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
44292621 | 176440 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46288 | 176440 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 6 | 2 | 6 | 5.7 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
9959121 | 187775 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50120 | 187775 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
21254089 | 181075 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47761 | 181075 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293376 | 101205 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299301 | 101205 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44292984 | 176827 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c(C)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46383 | 176827 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c(C)c1 | 10.1016/s0960-894x(00)00318-8 | ||
11583756 | 189062 | 0 | None | 31 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL515123 | 189062 | 0 | None | 31 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
21254068 | 101318 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL300045 | 101318 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293488 | 101084 | 0 | None | -1 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298366 | 101084 | 0 | None | -1 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293592 | 162340 | 0 | None | 4 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417363 | 162340 | 0 | None | 4 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293148 | 186903 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 524 | 12 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49412 | 186903 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 524 | 12 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
11532637 | 7633 | 0 | None | 4 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1088866 | 7633 | 0 | None | 4 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
44561397 | 189232 | 0 | None | -4 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL516479 | 189232 | 0 | None | -4 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44292608 | 177814 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 6 | 2 | 6 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccccc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46550 | 177814 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 6 | 2 | 6 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccccc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44577103 | 178168 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 530 | 10 | 4 | 9 | 4.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(O)NC)c21 | 10.1021/jm701249f | ||
CHEMBL468564 | 178168 | 0 | None | - | 1 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 530 | 10 | 4 | 9 | 4.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(O)NC)c21 | 10.1021/jm701249f | ||
44432645 | 86774 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 487 | 5 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CN)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232752 | 86774 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 487 | 5 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CN)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
16048665 | 128145 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 508 | 7 | 2 | 8 | 3.5 | COc1cc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)cc1COc1c(OC)ccc(F)c1F | nan | ||
CHEMBL3668016 | 128145 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 508 | 7 | 2 | 8 | 3.5 | COc1cc(F)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)cc1COc1c(OC)ccc(F)c1F | nan | ||
18914263 | 96453 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL265774 | 96453 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
11532637 | 7633 | 0 | None | -4 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1088866 | 7633 | 0 | None | -4 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
44380192 | 57146 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165534 | 57146 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
11634198 | 186783 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493344 | 186783 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
44380624 | 58826 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 587 | 8 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169873 | 58826 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 587 | 8 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293274 | 100786 | 0 | None | -9 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296199 | 100786 | 0 | None | -9 | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
11604354 | 186941 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494400 | 186941 | 0 | None | 1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
44572235 | 188917 | 0 | None | -5 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
CHEMBL513998 | 188917 | 0 | None | -5 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
44359458 | 12041 | 0 | None | 15 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184171 | 12041 | 0 | None | 15 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL336884 | 12041 | 0 | None | 15 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44432654 | 159248 | 0 | None | -6 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL410547 | 159248 | 0 | None | -6 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44451342 | 96018 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 898 | 20 | 4 | 10 | 6.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL262334 | 96018 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 898 | 20 | 4 | 10 | 6.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
15602804 | 7998 | 0 | None | -70 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091209 | 7998 | 0 | None | -70 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44444630 | 154285 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400390 | 154285 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44293101 | 186535 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 513 | 8 | 2 | 8 | 5.5 | CC(=O)OCc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49162 | 186535 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 513 | 8 | 2 | 8 | 5.5 | CC(=O)OCc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
145951481 | 162405 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 620 | 10 | 1 | 10 | 3.6 | COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4174753 | 162405 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 620 | 10 | 1 | 10 | 3.6 | COc1ccccc1[C@@H](N)Cn1c(=O)c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
25193797 | 189073 | 0 | None | 4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL515200 | 189073 | 0 | None | 4 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44593415 | 188790 | 0 | None | 20 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL512893 | 188790 | 0 | None | 20 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44444617 | 93711 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249372 | 93711 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44380319 | 58442 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168615 | 58442 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44451319 | 95728 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 882 | 15 | 3 | 10 | 6.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL260647 | 95728 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 882 | 15 | 3 | 10 | 6.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44451396 | 156132 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 842 | 16 | 4 | 10 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL406958 | 156132 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 842 | 16 | 4 | 10 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
25113693 | 161365 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 896 | 15 | 3 | 10 | 6.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccccc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL415279 | 161365 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 896 | 15 | 3 | 10 | 6.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccccc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44432639 | 86535 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 536 | 10 | 2 | 4 | 5.8 | COc1ccccc1CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232356 | 86535 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 536 | 10 | 2 | 4 | 5.8 | COc1ccccc1CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
10209293 | 100732 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295791 | 100732 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 7 | 4 | 6 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44434431 | 88083 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 909 | 24 | 3 | 15 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL235132 | 88083 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 909 | 24 | 3 | 15 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
11331001 | 188435 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
44432642 | 153060 | 0 | None | 1 | 2 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL398060 | 153060 | 0 | None | 1 | 2 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44293591 | 101125 | 0 | None | -1 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298700 | 101125 | 0 | None | -1 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44432635 | 86356 | 0 | None | -5 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232150 | 86356 | 0 | None | -5 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44341056 | 114036 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL333614 | 114036 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44398120 | 155751 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 1660 | 41 | 17 | 19 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(=O)N(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL406535 | 155751 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 1660 | 41 | 17 | 19 | -0.1 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(=O)N(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44561369 | 189874 | 0 | None | -15 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL517881 | 189874 | 0 | None | -15 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44432646 | 146701 | 0 | None | -2 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392843 | 146701 | 0 | None | -2 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44358962 | 12037 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184155 | 12037 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL335764 | 12037 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44395583 | 123827 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 524 | 7 | 2 | 8 | 5.8 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL363663 | 123827 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 524 | 7 | 2 | 8 | 5.8 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL268875 | 209026 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | None | None | None | CCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
15602805 | 8023 | 0 | None | 11 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091579 | 8023 | 0 | None | 11 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
44295755 | 192519 | 0 | None | 46 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111956 | 192519 | 0 | None | 46 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL52278 | 192519 | 0 | None | 46 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44380513 | 119686 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 631 | 10 | 4 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(CO)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL351836 | 119686 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 631 | 10 | 4 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(CO)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380147 | 119772 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352566 | 119772 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
1184 | 3676 | 31 | None | 2 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
9874838 | 3676 | 31 | None | 2 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
CHEMBL71917 | 3676 | 31 | None | 2 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
16156572 | 166560 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1678 | 48 | 16 | 18 | 5.2 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL429016 | 166560 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1678 | 48 | 16 | 18 | 5.2 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
44398395 | 96532 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1751 | 45 | 17 | 20 | 2.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CN(Cc1ccccn1)Cc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL266444 | 96532 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1751 | 45 | 17 | 20 | 2.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CN(Cc1ccccn1)Cc1ccccn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44448991 | 154802 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
16146554 | 160912 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO | 10.1021/jm0003900 | ||
CHEMBL412749 | 160912 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO | 10.1021/jm0003900 | ||
10051739 | 85008 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL22653 | 85008 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
44398181 | 155141 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1710 | 43 | 18 | 19 | 2.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNc1ccc2ccccc2n1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL404973 | 155141 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1710 | 43 | 18 | 19 | 2.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCNc1ccc2ccccc2n1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
16147453 | 96670 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL267622 | 96670 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
9808288 | 110993 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL327704 | 110993 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11421518 | 164744 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL423291 | 164744 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
9808288 | 110993 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL327704 | 110993 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44361796 | 82979 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1583 | 42 | 17 | 18 | 0.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL219461 | 82979 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1583 | 42 | 17 | 18 | 0.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
44395533 | 66465 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 2 | 8 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CC3CCN2CC3)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185986 | 66465 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 2 | 8 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CC3CCN2CC3)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44380148 | 119805 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352782 | 119805 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9985901 | 109964 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL324654 | 109964 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
71449058 | 83985 | 0 | None | 10 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111955 | 83985 | 0 | None | 10 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2219718 | 83985 | 0 | None | 10 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
145991962 | 166279 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 531 | 5 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6nc7ccccc7[nH]6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4285058 | 166279 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 531 | 5 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6nc7ccccc7[nH]6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
44292988 | 181859 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47862 | 181859 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293411 | 188182 | 0 | None | - | 1 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50552 | 188182 | 0 | None | - | 1 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44359287 | 11530 | 0 | None | -38 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180743 | 11530 | 0 | None | -38 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139993 | 11530 | 0 | None | -38 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293163 | 188115 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50433 | 188115 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44398086 | 96588 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL266893 | 96588 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 1645 | 41 | 16 | 18 | 1.9 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44451379 | 168414 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 884 | 17 | 4 | 10 | 6.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL439076 | 168414 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 884 | 17 | 4 | 10 | 6.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44359471 | 12092 | 0 | None | -67 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184266 | 12092 | 0 | None | -67 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341717 | 12092 | 0 | None | -67 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44434428 | 146221 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 865 | 21 | 3 | 14 | 5.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392435 | 146221 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 865 | 21 | 3 | 14 | 5.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44292606 | 101074 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 445 | 6 | 2 | 6 | 5.2 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(F)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL298300 | 101074 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 445 | 6 | 2 | 6 | 5.2 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cccc(F)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44292862 | 181065 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 477 | 6 | 2 | 6 | 6.2 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc4ccccc4c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL47758 | 181065 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 477 | 6 | 2 | 6 | 6.2 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc4ccccc4c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44293486 | 186834 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49374 | 186834 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44572287 | 180221 | 0 | None | -9 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475660 | 180221 | 0 | None | -9 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44293366 | 161662 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL416285 | 161662 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293250 | 101263 | 0 | None | -1 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299615 | 101263 | 0 | None | -1 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44432636 | 86957 | 0 | None | -8 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233341 | 86957 | 0 | None | -8 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44460343 | 203634 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 606 | 11 | 2 | 4 | 7.6 | COCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL79639 | 203634 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 606 | 11 | 2 | 4 | 7.6 | COCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44293301 | 187921 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50283 | 187921 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44432643 | 146234 | 0 | None | 1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392446 | 146234 | 0 | None | 1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44293274 | 100786 | 0 | None | 9 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296199 | 100786 | 0 | None | 9 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
22100905 | 183684 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48380 | 183684 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44593425 | 176191 | 0 | None | -12 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460480 | 176191 | 0 | None | -12 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
44293250 | 101263 | 0 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299615 | 101263 | 0 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
58239302 | 161441 | 0 | None | -616 | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4159247 | 161441 | 0 | None | -616 | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
11583756 | 189062 | 0 | None | -31 | 2 | Rat | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL515123 | 189062 | 0 | None | -31 | 2 | Rat | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44359193 | 11533 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180764 | 11533 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141750 | 11533 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293323 | 100746 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ncccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295911 | 100746 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ncccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
22129993 | 178150 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 558 | 7 | 4 | 5 | 6.2 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3cccc(Br)c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46844 | 178150 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 558 | 7 | 4 | 5 | 6.2 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3cccc(Br)c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
44292745 | 187331 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1ccc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49667 | 187331 | 0 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1ccc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
16144515 | 155586 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL406337 | 155586 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
11249548 | 98633 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL280664 | 98633 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
16221328 | 85173 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1530 | 41 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL228197 | 85173 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1530 | 41 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](SC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
145949496 | 162308 | 0 | None | 165 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173065 | 162308 | 0 | None | 165 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
44361802 | 168283 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1547 | 41 | 15 | 16 | 2.6 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](Cc2ccc(CNC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL438018 | 168283 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1547 | 41 | 15 | 16 | 2.6 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](Cc2ccc(CNC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44340906 | 9480 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 578 | 9 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL112400 | 9480 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 578 | 9 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44321291 | 204554 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 632 | 11 | 2 | 3 | 9.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5(C)CC4CC(C)(C)C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86950 | 204554 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 632 | 11 | 2 | 3 | 9.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5(C)CC4CC(C)(C)C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
10032223 | 12097 | 0 | None | 81 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184284 | 12097 | 0 | None | 81 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342822 | 12097 | 0 | None | 81 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44432652 | 96693 | 0 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL267838 | 96693 | 0 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44380514 | 119707 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 645 | 10 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(=O)O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352051 | 119707 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 645 | 10 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(=O)O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL262747 | 208801 | 8 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
44321292 | 204563 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCCC4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87000 | 204563 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCCC4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44380797 | 58980 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170499 | 58980 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL2105773 | 210994 | 7 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
CHEMBL409018 | 210994 | 7 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
16221151 | 143064 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1564 | 40 | 13 | 16 | 3.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)[S+](C)[O-])C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
CHEMBL389945 | 143064 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1564 | 40 | 13 | 16 | 3.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)[S+](C)[O-])C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0613931 | ||
15602806 | 8212 | 0 | None | 7 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092638 | 8212 | 0 | None | 7 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44432648 | 149694 | 0 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL395225 | 149694 | 0 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44292728 | 100767 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 487 | 8 | 2 | 8 | 5.1 | COc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1OC | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296086 | 100767 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 487 | 8 | 2 | 8 | 5.1 | COc1ccc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc1OC | 10.1016/s0960-894x(00)00318-8 | ||
44293305 | 100991 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL297703 | 100991 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293071 | 101130 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298748 | 101130 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293165 | 101223 | 0 | None | 7 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299392 | 101223 | 0 | None | 7 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44341080 | 110089 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.4 | CCCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL325417 | 110089 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.4 | CCCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44293347 | 162561 | 0 | None | -4 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417720 | 162561 | 0 | None | -4 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293617 | 188090 | 0 | None | 23 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50380 | 188090 | 0 | None | 23 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44432643 | 146234 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392446 | 146234 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44293100 | 186683 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 485 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc(C(C)O)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49276 | 186683 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 485 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)cc(C(C)O)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44561368 | 176240 | 0 | None | 42 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460892 | 176240 | 0 | None | 42 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44432636 | 86957 | 0 | None | 8 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233341 | 86957 | 0 | None | 8 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44432655 | 148954 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 675 | 11 | 3 | 6 | 6.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCOc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL394634 | 148954 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 675 | 11 | 3 | 6 | 6.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCOc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11583756 | 189062 | 0 | None | 31 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL515123 | 189062 | 0 | None | 31 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
11712618 | 179646 | 0 | None | 22 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL474992 | 179646 | 0 | None | 22 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
25194091 | 188423 | 0 | None | 13 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL508898 | 188423 | 0 | None | 13 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44214108 | 100647 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295152 | 100647 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
145952498 | 162326 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 719 | 14 | 2 | 10 | 4.8 | COc1ccccc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(=O)O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173316 | 162326 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 719 | 14 | 2 | 10 | 4.8 | COc1ccccc1[C@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2F)c1=O)NCCCC(=O)O | 10.1016/j.ejmech.2017.12.095 | ||
44321148 | 96360 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 622 | 11 | 2 | 5 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CC4)OCCO5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL265042 | 96360 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 622 | 11 | 2 | 5 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CC4)OCCO5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321509 | 204468 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CCCC[C@H]5C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86431 | 204468 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CCCC[C@H]5C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44292874 | 183258 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 616 | 13 | 3 | 4 | 7.2 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)(C)C | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL48069 | 183258 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 616 | 13 | 3 | 4 | 7.2 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)(C)C | 10.1016/s0960-894x(01)00274-8 | ||
10187208 | 66415 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 540 | 7 | 2 | 9 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2OCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185785 | 66415 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 540 | 7 | 2 | 9 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2OCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44434386 | 89378 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 638 | 11 | 2 | 8 | 5.1 | C#CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL237734 | 89378 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 638 | 11 | 2 | 8 | 5.1 | C#CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44434391 | 89657 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 926 | 27 | 2 | 16 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL238177 | 89657 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 926 | 27 | 2 | 16 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44293015 | 174465 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 530 | 7 | 4 | 5 | 6.6 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3ccc4ccccc4c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45675 | 174465 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 530 | 7 | 4 | 5 | 6.6 | O=C(Nc1cc2c(OCCC3CCCCN3)c(-c3ccc4ccccc4c3)c(O)nc2cc1Cl)NC1CC1 | 10.1016/s0960-894x(00)00318-8 | ||
44432648 | 149694 | 0 | None | -1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL395225 | 149694 | 0 | None | -1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44451356 | 95916 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 870 | 18 | 4 | 10 | 5.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL261649 | 95916 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 870 | 18 | 4 | 10 | 5.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44293129 | 181154 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL47772 | 181154 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
22129998 | 100805 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296321 | 100805 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44572236 | 171333 | 0 | None | -6 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL446978 | 171333 | 0 | None | -6 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44293264 | 100744 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 560 | 12 | 3 | 4 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295908 | 100744 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 560 | 12 | 3 | 4 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
16148338 | 161399 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL415573 | 161399 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
10649568 | 14397 | 0 | None | 4 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 4 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
44321290 | 204680 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 548 | 9 | 2 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87785 | 204680 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 548 | 9 | 2 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44432654 | 159248 | 0 | None | 6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL410547 | 159248 | 0 | None | 6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
9961721 | 167914 | 0 | None | 60 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL435167 | 167914 | 0 | None | 60 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
16144832 | 161230 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL414061 | 161230 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
10231401 | 1989 | 1 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
5584 | 1989 | 1 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL314260 | 1989 | 1 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
44572235 | 188917 | 0 | None | 5 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
CHEMBL513998 | 188917 | 0 | None | 5 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
44340888 | 110036 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 592 | 10 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(CO)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL325091 | 110036 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 592 | 10 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(CO)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44380552 | 58451 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168655 | 58451 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380643 | 58410 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 7.7 | COC(=O)c1nc2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4ccc(C(C)(C)C(=O)N5CC6CCC5CC6)cc34)ccc2[nH]1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168498 | 58410 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 659 | 10 | 3 | 5 | 7.7 | COC(=O)c1nc2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4ccc(C(C)(C)C(=O)N5CC6CCC5CC6)cc34)ccc2[nH]1 | 10.1016/s0960-894x(02)00026-4 | ||
44361468 | 161183 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL413698 | 161183 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
16147757 | 161255 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL414266 | 161255 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
16144824 | 96399 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)CO | 10.1021/jm0003900 | ||
CHEMBL265286 | 96399 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)CO | 10.1021/jm0003900 | ||
44361351 | 160412 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](Cc2ccc(CNC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL411565 | 160412 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](Cc2ccc(CNC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361797 | 161254 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1659 | 42 | 17 | 18 | 1.5 | CNC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL414249 | 161254 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1659 | 42 | 17 | 18 | 1.5 | CNC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44293223 | 173729 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 545 | 8 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(CC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45501 | 173729 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 545 | 8 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(CC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
9809394 | 120004 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 628 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL354524 | 120004 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 628 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293178 | 100952 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297430 | 100952 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
9809382 | 100208 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL292291 | 100208 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44434373 | 89617 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 637 | 11 | 3 | 7 | 4.6 | C#CCNC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL238160 | 89617 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 637 | 11 | 3 | 7 | 4.6 | C#CCNC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44292820 | 100697 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 498 | 8 | 3 | 7 | 4.4 | Cc1cc(CC(N)=O)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295556 | 100697 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 498 | 8 | 3 | 7 | 4.4 | Cc1cc(CC(N)=O)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44293011 | 100785 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 563 | 6 | 2 | 6 | 7.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296198 | 100785 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 563 | 6 | 2 | 6 | 7.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44573791 | 186805 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493565 | 186805 | 0 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44215055 | 100820 | 0 | None | 1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296442 | 100820 | 0 | None | 1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293249 | 184861 | 0 | None | -1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48616 | 184861 | 0 | None | -1 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44292977 | 173665 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45489 | 173665 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44434415 | 88099 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 821 | 18 | 3 | 13 | 5.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL235180 | 88099 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 821 | 18 | 3 | 13 | 5.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44434432 | 88320 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 953 | 27 | 3 | 16 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL236221 | 88320 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 953 | 27 | 3 | 16 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44215053 | 185038 | 0 | None | 1 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48641 | 185038 | 0 | None | 1 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293485 | 101045 | 0 | None | 2 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298051 | 101045 | 0 | None | 2 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
44444663 | 93766 | 0 | None | -4 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249771 | 93766 | 0 | None | -4 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44593415 | 188790 | 0 | None | -20 | 2 | Rat | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL512893 | 188790 | 0 | None | -20 | 2 | Rat | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44359287 | 11530 | 0 | None | 38 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180743 | 11530 | 0 | None | 38 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139993 | 11530 | 0 | None | 38 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
22100905 | 183684 | 0 | None | 1 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48380 | 183684 | 0 | None | 1 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44359303 | 11532 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180760 | 11532 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141539 | 11532 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44359285 | 11522 | 0 | None | -17 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180695 | 11522 | 0 | None | -17 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138747 | 11522 | 0 | None | -17 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44576656 | 187663 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 571 | 10 | 2 | 7 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccc(COCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL499588 | 187663 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 571 | 10 | 2 | 7 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccc(COCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
138978204 | 166201 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 461 | 6 | 1 | 6 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(CCF)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4283577 | 166201 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 461 | 6 | 1 | 6 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(CCF)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
145992260 | 166381 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 744 | 10 | 2 | 14 | 3.3 | CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1 | 10.1039/C7MD00320J | ||
CHEMBL4286937 | 166381 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 744 | 10 | 2 | 14 | 3.3 | CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1 | 10.1039/C7MD00320J | ||
16147451 | 96566 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1644 | 41 | 15 | 18 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL266653 | 96566 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1644 | 41 | 15 | 18 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL2370894 | 208201 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
16147765 | 161302 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cnc(O)nc3O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361477 | 161302 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cnc(O)nc3O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL414715 | 161302 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1628 | 41 | 16 | 20 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)c3cnc(O)nc3O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
10051739 | 85008 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL22653 | 85008 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
44321345 | 204519 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 596 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCC2CCC(=O)N(C)C2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86758 | 204519 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 596 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCC2CCC(=O)N(C)C2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
10258659 | 12093 | 0 | None | 46 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184268 | 12093 | 0 | None | 46 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341809 | 12093 | 0 | None | 46 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293487 | 101163 | 0 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299006 | 101163 | 0 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
145973618 | 162535 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 635 | 8 | 1 | 8 | 4.7 | Cc1cc(F)cc([C@@H](N)Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4176683 | 162535 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 635 | 8 | 1 | 8 | 4.7 | Cc1cc(F)cc([C@@H](N)Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
44380236 | 58413 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 641 | 11 | 2 | 4 | 8.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168506 | 58413 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 641 | 11 | 2 | 4 | 8.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
16144222 | 96574 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL266728 | 96574 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44341113 | 9828 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL114438 | 9828 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44321411 | 106526 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@@H]5CC[C@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315326 | 106526 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@@H]5CC[C@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
101755083 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
44361587 | 160764 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O | 10.1021/jm0003900 | ||
CHEMBL412336 | 160764 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O | 10.1021/jm0003900 | ||
9872676 | 77826 | 0 | None | -2 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
CHEMBL210514 | 77826 | 0 | None | -2 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
44321412 | 204529 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86805 | 204529 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 590 | 11 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
16144865 | 83027 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1648 | 43 | 18 | 18 | 1.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)C(NC(N)=O)NC(N)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL219799 | 83027 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 1648 | 43 | 18 | 18 | 1.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)C(NC(N)=O)NC(N)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
53239183 | 162293 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 603 | 8 | 1 | 8 | 4.3 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4172886 | 162293 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 603 | 8 | 1 | 8 | 4.3 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
58022331 | 128134 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 473 | 3 | 1 | 6 | 3.5 | O=c1[nH]c2sccc2c(=O)n1-c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl | nan | ||
CHEMBL3668004 | 128134 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 473 | 3 | 1 | 6 | 3.5 | O=c1[nH]c2sccc2c(=O)n1-c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl | nan | ||
44292918 | 170849 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL44627 | 170849 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
9936667 | 100052 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 525 | 10 | 3 | 4 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL291201 | 100052 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 525 | 10 | 3 | 4 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44432627 | 147596 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 430 | 7 | 2 | 3 | 4.5 | CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL393540 | 147596 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 430 | 7 | 2 | 3 | 4.5 | CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
10649568 | 14397 | 0 | None | -4 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | -4 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
44293177 | 174131 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 644 | 13 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45597 | 174131 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 644 | 13 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
10438167 | 100712 | 0 | None | -15 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295641 | 100712 | 0 | None | -15 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44321695 | 105501 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccn(C)c2=O)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313086 | 105501 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccn(C)c2=O)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44292979 | 187606 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 483 | 10 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49893 | 187606 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 483 | 10 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
11712618 | 179646 | 0 | None | -22 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL474992 | 179646 | 0 | None | -22 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44293151 | 100705 | 0 | None | -23 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295595 | 100705 | 0 | None | -23 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
44560995 | 178574 | 0 | None | -9 | 2 | Rat | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL472117 | 178574 | 0 | None | -9 | 2 | Rat | 4.1 | pIC50 | = | 4.1 | Functional | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44434433 | 88321 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 997 | 30 | 3 | 17 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL236222 | 88321 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 997 | 30 | 3 | 17 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCN=[N+]=[N-])nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44434436 | 150440 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 1619 | 39 | 6 | 26 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL395825 | 150440 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 1619 | 39 | 6 | 26 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
16221379 | 161382 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 1546 | 41 | 15 | 17 | 1.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
CHEMBL415380 | 161382 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 1546 | 41 | 15 | 17 | 1.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)[S+]([O-])C(C)C)cc1 | 10.1021/jm0613931 | ||
58022131 | 128137 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 442 | 5 | 2 | 6 | 4.0 | Cc1ccccc1COc1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
CHEMBL3668007 | 128137 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 442 | 5 | 2 | 6 | 4.0 | Cc1ccccc1COc1ccc(Cl)c(-n2c(=O)[nH]c3csc(C(=O)O)c3c2=O)c1 | nan | ||
44432642 | 153060 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL398060 | 153060 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44432649 | 86272 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 645 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]c(C)nc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231739 | 86272 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 645 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]c(C)nc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44359264 | 11523 | 0 | None | -11 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180700 | 11523 | 0 | None | -11 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138866 | 11523 | 0 | None | -11 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44185958 | 154459 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401349 | 154459 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
145956692 | 161524 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 606 | 9 | 2 | 10 | 3.3 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4160698 | 161524 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 606 | 9 | 2 | 10 | 3.3 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
44380488 | 58707 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ocnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169238 | 58707 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ocnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44432652 | 96693 | 0 | None | -1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL267838 | 96693 | 0 | None | -1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
16146884 | 96722 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CNC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL268146 | 96722 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CNC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44398118 | 166744 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1632 | 41 | 18 | 19 | -0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
CHEMBL429378 | 166744 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1632 | 41 | 18 | 19 | -0.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm050134t | ||
44593424 | 175559 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL459215 | 175559 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44593424 | 175559 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459215 | 175559 | 0 | None | 4 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
16156706 | 136577 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1745 | 48 | 17 | 19 | 4.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL374747 | 136577 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1745 | 48 | 17 | 19 | 4.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
16144863 | 96427 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL265556 | 96427 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16156706 | 136577 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1745 | 48 | 17 | 19 | 4.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
CHEMBL374747 | 136577 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 1745 | 48 | 17 | 19 | 4.0 | CCCCCCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)NOC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm060240a | ||
11620431 | 178789 | 0 | None | 21 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL473807 | 178789 | 0 | None | 21 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
15602807 | 8136 | 0 | None | 8 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092245 | 8136 | 0 | None | 8 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44293485 | 101045 | 0 | None | -2 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298051 | 101045 | 0 | None | -2 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
44292837 | 101002 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 6 | 2 | 7 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccsc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL297768 | 101002 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 433 | 6 | 2 | 7 | 5.1 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccsc3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44292683 | 186374 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 537 | 7 | 2 | 6 | 7.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(-c4ccccc4)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49028 | 186374 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 537 | 7 | 2 | 6 | 7.4 | O=[N+]([O-])c1cc2c(OCCC3CCCCN3)c(-c3ccc(-c4ccccc4)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44293134 | 186818 | 0 | None | -1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49366 | 186818 | 0 | None | -1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44432650 | 86344 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 703 | 10 | 3 | 5 | 6.5 | CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4c3CN(C(=O)Cc3c(F)cccc3C(F)(F)F)CC4)ccc2c1=O | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232097 | 86344 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 703 | 10 | 3 | 5 | 6.5 | CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4c3CN(C(=O)Cc3c(F)cccc3C(F)(F)F)CC4)ccc2c1=O | 10.1016/j.bmcl.2007.05.009 | ||
15602806 | 8212 | 0 | None | -7 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092638 | 8212 | 0 | None | -7 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44560995 | 178574 | 0 | None | 9 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL472117 | 178574 | 0 | None | 9 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44321147 | 162928 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 618 | 11 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CCCC5)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL420051 | 162928 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 618 | 11 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CCCC5)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44293443 | 183469 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48224 | 183469 | 0 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293511 | 100816 | 0 | None | -3 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296426 | 100816 | 0 | None | -3 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44444645 | 154461 | 0 | None | -5 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401351 | 154461 | 0 | None | -5 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
44293075 | 90233 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL239108 | 90233 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292827 | 187605 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49891 | 187605 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44434404 | 166015 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 1477 | 33 | 4 | 24 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL427981 | 166015 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 1477 | 33 | 4 | 24 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44432635 | 86356 | 0 | None | 5 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232150 | 86356 | 0 | None | 5 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44295755 | 192519 | 0 | None | -46 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111956 | 192519 | 0 | None | -46 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL52278 | 192519 | 0 | None | -46 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293486 | 186834 | 0 | None | 1 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49374 | 186834 | 0 | None | 1 | 2 | Rat | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293222 | 175387 | 0 | None | -100 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL138464 | 175387 | 0 | None | -100 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45883 | 175387 | 0 | None | -100 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44359289 | 12045 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184180 | 12045 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL337323 | 12045 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
44361351 | 160412 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](Cc2ccc(CNC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL411565 | 160412 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](Cc2ccc(CNC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16144515 | 155586 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL406337 | 155586 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 1533 | 40 | 15 | 16 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL1251 | 206919 | 21 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | None | None | None | CC/N=C(\NCC)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCN/C(=N/CC)NCC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
CHEMBL2370890 | 208200 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
101755083 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16146884 | 96722 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CNC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL268146 | 96722 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CNC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361587 | 160764 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O | 10.1021/jm0003900 | ||
CHEMBL412336 | 160764 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1602 | 41 | 16 | 17 | 2.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(CNC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O | 10.1021/jm0003900 | ||
16146554 | 160912 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO | 10.1021/jm0003900 | ||
CHEMBL412749 | 160912 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CO | 10.1021/jm0003900 | ||
44361802 | 168283 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1547 | 41 | 15 | 16 | 2.6 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](Cc2ccc(CNC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL438018 | 168283 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 1547 | 41 | 15 | 16 | 2.6 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](Cc2ccc(CNC(N)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
1188 | 217 | 40 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16131215 | 217 | 40 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
35 | 217 | 40 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL1252 | 217 | 40 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB00106 | 217 | 40 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
44361796 | 82979 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1583 | 42 | 17 | 18 | 0.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL219461 | 82979 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1583 | 42 | 17 | 18 | 0.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
16147451 | 96566 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1644 | 41 | 15 | 18 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL266653 | 96566 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1644 | 41 | 15 | 18 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361797 | 161254 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1659 | 42 | 17 | 18 | 1.5 | CNC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL414249 | 161254 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 1659 | 42 | 17 | 18 | 1.5 | CNC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16144824 | 96399 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)CO | 10.1021/jm0003900 | ||
CHEMBL265286 | 96399 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1632 | 42 | 17 | 18 | 1.7 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)CO | 10.1021/jm0003900 | ||
16144863 | 96427 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL265556 | 96427 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16144222 | 96574 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL266728 | 96574 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
44361888 | 141244 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL386105 | 141244 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
44361468 | 161183 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL413698 | 161183 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 1728 | 42 | 18 | 20 | 0.6 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
1190 | 869 | 41 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
583 | 869 | 41 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0003900 | ||||
16147453 | 96670 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL267622 | 96670 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 1645 | 42 | 17 | 18 | 1.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(CNC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
16147767 | 96910 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL269516 | 96910 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 1630 | 41 | 16 | 18 | 2.0 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL268875 | 209026 | 0 | None | - | 1 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | None | None | None | CCNC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(=O)NCC)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
9854500 | 101802 | 0 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm701249f | ||
CHEMBL303274 | 101802 | 0 | None | - | 0 | Rat | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm701249f | ||
16148338 | 161399 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
CHEMBL415573 | 161399 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 1644 | 42 | 16 | 18 | 1.7 | CC(=O)NCc1ccc(C[C@@H](NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||
16146022 | 169552 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 1631 | 41 | 17 | 18 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL444381 | 169552 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 1631 | 41 | 17 | 18 | 1.5 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL269711 | 209056 | 0 | None | - | 1 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
CHEMBL2105773 | 210994 | 7 | None | -1 | 2 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
CHEMBL409018 | 210994 | 7 | None | -1 | 2 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||||
44361795 | 167933 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 1574 | 40 | 15 | 18 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL435322 | 167933 | 0 | None | - | 1 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 1574 | 40 | 15 | 18 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm0003900 | ||
CHEMBL262747 | 208801 | 8 | None | 1 | 2 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm0003900 | ||||
10394119 | 113949 | 0 | None | - | 0 | Rat | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333345 | 113949 | 0 | None | - | 0 | Rat | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
1184 | 3676 | 31 | None | 2 | 2 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
9874838 | 3676 | 31 | None | 2 | 2 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
CHEMBL71917 | 3676 | 31 | None | 2 | 2 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
145991962 | 166279 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 531 | 5 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6nc7ccccc7[nH]6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4285058 | 166279 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 531 | 5 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6nc7ccccc7[nH]6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
11583756 | 189062 | 0 | None | 31 | 2 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL515123 | 189062 | 0 | None | 31 | 2 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
138978204 | 166201 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 461 | 6 | 1 | 6 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(CCF)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4283577 | 166201 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 461 | 6 | 1 | 6 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(CCF)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
145992260 | 166381 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 744 | 10 | 2 | 14 | 3.3 | CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1 | 10.1039/C7MD00320J | ||
CHEMBL4286937 | 166381 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 744 | 10 | 2 | 14 | 3.3 | CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1 | 10.1039/C7MD00320J | ||
145993478 | 166766 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 602 | 8 | 3 | 9 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1)C(=O)O | 10.1039/C7MD00320J | ||
CHEMBL4294163 | 166766 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 602 | 8 | 3 | 9 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1)C(=O)O | 10.1039/C7MD00320J | ||
1179 | 947 | 31 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
9957278 | 947 | 31 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
CHEMBL494803 | 947 | 31 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
145980339 | 166034 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 380 | 4 | 1 | 3 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCF)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4280124 | 166034 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 380 | 4 | 1 | 3 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCF)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
138978203 | 166147 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 639 | 7 | 3 | 11 | 3.1 | Cc1cn([C@H]2C[C@@H](n3cc(CN4CCN(c5cccc6[nH]c(-c7ccc(C(C)(C)C)cc7)nc56)CC4)nn3)[C@@H](CO)O2)c(=O)[nH]c1=O | 10.1039/C7MD00320J | ||
CHEMBL4282476 | 166147 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 639 | 7 | 3 | 11 | 3.1 | Cc1cn([C@H]2C[C@@H](n3cc(CN4CCN(c5cccc6[nH]c(-c7ccc(C(C)(C)C)cc7)nc56)CC4)nn3)[C@@H](CO)O2)c(=O)[nH]c1=O | 10.1039/C7MD00320J | ||
138978207 | 166600 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | C#CCN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1039/C7MD00320J | ||
CHEMBL4290761 | 166600 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | C#CCN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1039/C7MD00320J | ||
145984647 | 165863 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 509 | 5 | 1 | 6 | 5.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6ccc(F)cc6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
CHEMBL4277116 | 165863 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 509 | 5 | 1 | 6 | 5.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn(-c6ccc(F)cc6)nn5)CC4)cccc3[nH]2)cc1 | 10.1039/C7MD00320J | ||
3860 | 733 | 0 | None | -2 | 2 | Mouse | 8.0 | pEC50 | = | 8 | Functional | Drug Central | None | None | None | None | None | ||||
436 | 733 | 0 | None | -2 | 2 | Mouse | 8.0 | pEC50 | = | 8 | Functional | Drug Central | None | None | None | None | None | ||||
50225 | 733 | 0 | None | -2 | 2 | Mouse | 8.0 | pEC50 | = | 8 | Functional | Drug Central | None | None | None | None | None | ||||
CHEMBL2110824 | 733 | 0 | None | -2 | 2 | Mouse | 8.0 | pEC50 | = | 8 | Functional | Drug Central | None | None | None | None | None | ||||
DB06719 | 733 | 0 | None | -2 | 2 | Mouse | 8.0 | pEC50 | = | 8 | Functional | Drug Central | None | None | None | None | None | ||||
3860 | 733 | 0 | None | 2 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
436 | 733 | 0 | None | 2 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
50225 | 733 | 0 | None | 2 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
CHEMBL2110824 | 733 | 0 | None | 2 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
DB06719 | 733 | 0 | None | 2 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
1177 | 3806 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
25074470 | 3806 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
2968 | 3806 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
CHEMBL1201334 | 3806 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
DB06825 | 3806 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
1162 | 1801 | 0 | None | 16 | 3 | Human | 10.0 | pEC50 | = | 10 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
16132914 | 1801 | 0 | None | 16 | 3 | Human | 10.0 | pEC50 | = | 10 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
3860 | 733 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
436 | 733 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
50225 | 733 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
CHEMBL2110824 | 733 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
DB06719 | 733 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
1162 | 1801 | 0 | None | -16 | 3 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
16132914 | 1801 | 0 | None | -16 | 3 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
3860 | 733 | 0 | None | -2 | 2 | Mouse | 9.7 | pEC50 | = | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
436 | 733 | 0 | None | -2 | 2 | Mouse | 9.7 | pEC50 | = | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
50225 | 733 | 0 | None | -2 | 2 | Mouse | 9.7 | pEC50 | = | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
CHEMBL2110824 | 733 | 0 | None | -2 | 2 | Mouse | 9.7 | pEC50 | = | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
DB06719 | 733 | 0 | None | -2 | 2 | Mouse | 9.7 | pEC50 | = | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
11980076 | 206711 | 27 | None | 1 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | None | ||||
CHEMBL1007 | 206711 | 27 | None | 1 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | None | ||||
11250647 | 1516 | 40 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
5293 | 1516 | 40 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
8362 | 1516 | 40 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
CHEMBL1208155 | 1516 | 40 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
DB11979 | 1516 | 40 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
10348973 | 3261 | 50 | None | 1 | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
5432 | 3261 | 50 | None | 1 | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
5586 | 3261 | 50 | None | 1 | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
CHEMBL1800159 | 3261 | 50 | None | 1 | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
DB11853 | 3261 | 50 | None | 1 | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
1175 | 2266 | 38 | None | 1 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
1559 | 2266 | 38 | None | 1 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
657181 | 2266 | 38 | None | 1 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
CHEMBL1201199 | 2266 | 38 | None | 1 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
DB00007 | 2266 | 38 | None | 1 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | None | None | None | None | None | ||||
10348973 | 3261 | 50 | None | -1 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
5432 | 3261 | 50 | None | -1 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
5586 | 3261 | 50 | None | -1 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
CHEMBL1800159 | 3261 | 50 | None | -1 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
DB11853 | 3261 | 50 | None | -1 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Drug Central | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | None | ||
12784 | 571 | 8 | None | 1 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 32960053 | ||
85469632 | 571 | 8 | None | 1 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 32960053 | ||
CHEMBL4537788 | 571 | 8 | None | 1 | 3 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 32960053 | ||
12283 | 2292 | 12 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | 35690889 | ||
16656889 | 2292 | 12 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | 35690889 | ||
CHEMBL3668014 | 2292 | 12 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 508 | 7 | 2 | 8 | 3.5 | COc1c(c(c(cc1)F)F)COc1c(cc(c(c1)n1c(=O)c2c(scc2[nH]c1=O)C(=O)O)F)OC | 35690889 | ||
11496610 | 4012 | 11 | None | -8 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
5582 | 4012 | 11 | None | -8 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
CHEMBL474991 | 4012 | 11 | None | -8 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
1164 | 1802 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1164 | 1802 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 17942747 | ||||
1164 | 1802 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 19638591 | ||||
5581 | 1418 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | None | None | None | None | 19638591 | ||||
11496610 | 4012 | 11 | None | 8 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
5582 | 4012 | 11 | None | 8 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
CHEMBL474991 | 4012 | 11 | None | 8 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 19271735 | ||
1162 | 1801 | 0 | None | 16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
16132914 | 1801 | 0 | None | 16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1190 | 869 | 41 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
583 | 869 | 41 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
10231401 | 1989 | 1 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
5584 | 1989 | 1 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
CHEMBL314260 | 1989 | 1 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
101827019 | 2075 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
16130938 | 2075 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
3854 | 2075 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
73952264 | 2075 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
CHEMBL3989438 | 2075 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | Guide to Pharmacology | None | None | None | None | 11861490 | ||||
1175 | 2266 | 38 | None | -1 | 2 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
1559 | 2266 | 38 | None | -1 | 2 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
657181 | 2266 | 38 | None | -1 | 2 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
CHEMBL1201199 | 2266 | 38 | None | -1 | 2 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
DB00007 | 2266 | 38 | None | -1 | 2 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
5583 | 246 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | None | None | None | None | 19638591 | ||||
10231401 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
10231401 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 12107234 | ||
5584 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
5584 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 12107234 | ||
CHEMBL314260 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 11551758 | ||
CHEMBL314260 | 1989 | 1 | None | 1 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 12107234 | ||
10348973 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
10348973 | 3261 | 50 | None | 1 | 2 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
5432 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
5432 | 3261 | 50 | None | 1 | 2 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
5586 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
5586 | 3261 | 50 | None | 1 | 2 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
CHEMBL1800159 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
CHEMBL1800159 | 3261 | 50 | None | 1 | 2 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
DB11853 | 3261 | 50 | None | -1 | 2 | Human | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
DB11853 | 3261 | 50 | None | 1 | 2 | Rat | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 21657270 | ||
12394 | 2455 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | Guide to Pharmacology | 752 | 12 | 2 | 9 | 6.0 | C1CN(CCC21c1c(CO2)n(c(=O)n(c1=O)C[C@@H](c1ccccc1)NCCCC(=O)O)Cc1c(cccc1F)C(F)(F)F)Cc1ccc(o1)C(F)(F)F | 26321528 | ||
71727383 | 2455 | 0 | None | - | 1 | Human | 9.6 | pIC50 | = | 9.6 | Functional | Guide to Pharmacology | 752 | 12 | 2 | 9 | 6.0 | C1CN(CCC21c1c(CO2)n(c(=O)n(c1=O)C[C@@H](c1ccccc1)NCCCC(=O)O)Cc1c(cccc1F)C(F)(F)F)Cc1ccc(o1)C(F)(F)F | 26321528 | ||
1192 | 147 | 41 | None | -9 | 4 | Human | 4.3 | pIC50 | None | 4.3 | Functional | Guide to Pharmacology | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | 18344315 | ||
1794 | 147 | 41 | None | -9 | 4 | Human | 4.3 | pIC50 | None | 4.3 | Functional | Guide to Pharmacology | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | 18344315 | ||
CHEMBL501701 | 147 | 41 | None | -9 | 4 | Human | 4.3 | pIC50 | None | 4.3 | Functional | Guide to Pharmacology | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | 18344315 | ||
10279142 | 1596 | 0 | None | - | 1 | Human | 5.3 | pIC50 | None | 5.3 | Functional | Guide to Pharmacology | 509 | 7 | 1 | 8 | 6.0 | COc1nc(OC)c(c(n1)OC)NC(=O)c1ccc(o1)Oc1cc2c(cc1C)C(C)(C)C(CC2(C)C)C | 18344315 | ||
1182 | 1596 | 0 | None | - | 1 | Human | 5.3 | pIC50 | None | 5.3 | Functional | Guide to Pharmacology | 509 | 7 | 1 | 8 | 6.0 | COc1nc(OC)c(c(n1)OC)NC(=O)c1ccc(o1)Oc1cc2c(cc1C)C(C)(C)C(CC2(C)C)C | 18344315 | ||
1171 | 3532 | 0 | None | - | 1 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
118856782 | 3532 | 0 | None | - | 1 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1173 | 3835 | 0 | None | - | 1 | Human | 6.7 | pIC50 | None | 6.7 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1172 | 3813 | 0 | None | - | 1 | Human | 7.0 | pIC50 | None | 7 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
16130930 | 3813 | 0 | None | - | 1 | Human | 7.0 | pIC50 | None | 7 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1169 | 1778 | 0 | None | - | 1 | Human | 7.1 | pIC50 | None | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
123777 | 1778 | 0 | None | - | 1 | Human | 7.1 | pIC50 | None | 7.1 | Functional | Guide to Pharmacology | None | None | None | None | 17452338 | ||||
1162 | 1801 | 0 | None | -39 | 3 | Rat | 7.7 | pIC50 | None | 7.7 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
16132914 | 1801 | 0 | None | -39 | 3 | Rat | 7.7 | pIC50 | None | 7.7 | Functional | Guide to Pharmacology | None | None | None | None | 8013367 | ||||
1179 | 947 | 31 | None | - | 1 | Human | 7.8 | pIC50 | None | 7.8 | Functional | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 17176055 | ||
9957278 | 947 | 31 | None | - | 1 | Human | 7.8 | pIC50 | None | 7.8 | Functional | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 17176055 | ||
CHEMBL494803 | 947 | 31 | None | - | 1 | Human | 7.8 | pIC50 | None | 7.8 | Functional | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 17176055 | ||
1162 | 1801 | 0 | None | -16 | 3 | Mouse | 8.3 | pIC50 | None | 8.3 | Functional | Guide to Pharmacology | None | None | None | None | 1328228 | ||||
16132914 | 1801 | 0 | None | -16 | 3 | Mouse | 8.3 | pIC50 | None | 8.3 | Functional | Guide to Pharmacology | None | None | None | None | 1328228 | ||||
1184 | 3676 | 31 | None | 2 | 2 | Human | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 9784092 | ||
9874838 | 3676 | 31 | None | 2 | 2 | Human | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 9784092 | ||
CHEMBL71917 | 3676 | 31 | None | 2 | 2 | Human | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 9784092 | ||
1174 | 1359 | 0 | None | - | 1 | Mouse | 9.9 | pIC50 | None | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1328228 |
Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Affinity) |
# tested GPCRs (Affinity) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
44348326 | 96718 | 0 | None | - | 0 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL268095 | 96718 | 0 | None | - | 0 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
11563584 | 139018 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 630 | 10 | 2 | 7 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL379629 | 139018 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 630 | 10 | 2 | 7 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
10100930 | 63188 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800155 | 63188 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53388960 | 63237 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 682 | 11 | 2 | 9 | 6.0 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800663 | 63237 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 682 | 11 | 2 | 9 | 6.0 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
11692959 | 77760 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 612 | 10 | 2 | 7 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2sc(-c3ccc(NC(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210294 | 77760 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 612 | 10 | 2 | 7 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2sc(-c3ccc(NC(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
10348973 | 3261 | 50 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | - | 1 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
53387071 | 63190 | 4 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800157 | 63190 | 4 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL2370519 | 208122 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm010112g | ||||
53388958 | 63235 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800661 | 63235 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53389117 | 63240 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 688 | 11 | 2 | 9 | 4.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN2CCCC2=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800666 | 63240 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 688 | 11 | 2 | 9 | 4.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN2CCCC2=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL414239 | 161253 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1530 | 40 | 18 | 21 | -1.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CC/N=C1\C(=O)c2ccccc2C(O)=C1Cl)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm010112g | ||
10258719 | 152707 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 650 | 12 | 2 | 10 | 4.8 | CCOCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | nan | ||
CHEMBL3977463 | 152707 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 650 | 12 | 2 | 10 | 4.8 | CCOCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | nan | ||
1185 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
9939837 | 77497 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 651 | 9 | 2 | 7 | 6.6 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL2092994 | 77497 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 651 | 9 | 2 | 7 | 6.6 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
1185 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm701249f | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm701249f | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm701249f | ||
44395650 | 168755 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 4.9 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL441676 | 168755 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 4.9 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
53386915 | 63186 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800153 | 63186 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53389115 | 63238 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 698 | 11 | 3 | 10 | 5.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccc(CO)n2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800664 | 63238 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 698 | 11 | 3 | 10 | 5.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccc(CO)n2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
18324807 | 63242 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800668 | 63242 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
44293053 | 101022 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297918 | 101022 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292838 | 101047 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298074 | 101047 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292827 | 187605 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49891 | 187605 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
11700433 | 77257 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 675 | 11 | 1 | 6 | 8.5 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)c2ccccc2)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL208812 | 77257 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 675 | 11 | 1 | 6 | 8.5 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)c2ccccc2)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
11707186 | 77877 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 629 | 11 | 1 | 7 | 7.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210709 | 77877 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 629 | 11 | 1 | 7 | 7.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
20691661 | 79203 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211485 | 79203 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
11512905 | 137890 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL377396 | 137890 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
155524081 | 170314 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1542 | 39 | 20 | 23 | -4.2 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(N)nc2=O)C1(F)F)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
CHEMBL4454362 | 170314 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1542 | 39 | 20 | 23 | -4.2 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(N)nc2=O)C1(F)F)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
10371708 | 63191 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800158 | 63191 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
44293177 | 174131 | 0 | None | - | 0 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 644 | 13 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45597 | 174131 | 0 | None | - | 0 | Rat | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 644 | 13 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
67143119 | 175281 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 742 | 14 | 2 | 11 | 4.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCCCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4585638 | 175281 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 742 | 14 | 2 | 11 | 4.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCCCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143780 | 171686 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 637 | 9 | 1 | 8 | 4.7 | CC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4474379 | 171686 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 637 | 9 | 1 | 8 | 4.7 | CC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
67143102 | 172363 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 610 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C#N)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4516712 | 172363 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 610 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C#N)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143023 | 174425 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 656 | 9 | 2 | 10 | 4.2 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4566719 | 174425 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 656 | 9 | 2 | 10 | 4.2 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9895596 | 63185 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | nan | ||
CHEMBL1800152 | 63185 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | nan | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
9875078 | 75576 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 680 | 11 | 1 | 8 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL20511 | 75576 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 680 | 11 | 1 | 8 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9853275 | 79431 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 681 | 11 | 2 | 8 | 6.9 | CCONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21217 | 79431 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 681 | 11 | 2 | 8 | 6.9 | CCONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9831689 | 98560 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 679 | 10 | 2 | 7 | 7.4 | CC(C)NC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL280126 | 98560 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 679 | 10 | 2 | 7 | 7.4 | CC(C)NC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
23656390 | 161134 | 0 | None | - | 1 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1021/jm701249f | ||
CHEMBL413245 | 161134 | 0 | None | - | 1 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1021/jm701249f | ||
44321964 | 95972 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL261979 | 95972 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
9895596 | 63185 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800152 | 63185 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386916 | 63187 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 654 | 11 | 2 | 10 | 4.5 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(F)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800154 | 63187 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 654 | 11 | 2 | 10 | 4.5 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(F)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386917 | 63189 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800156 | 63189 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53388959 | 63236 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccnc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800662 | 63236 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 668 | 10 | 2 | 9 | 5.9 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2cccnc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53389118 | 63241 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 712 | 12 | 2 | 10 | 4.2 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN(C)S(C)(=O)=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800667 | 63241 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 712 | 12 | 2 | 10 | 4.2 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN(C)S(C)(=O)=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
53386756 | 63243 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 617 | 13 | 2 | 10 | 3.6 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCOC)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800669 | 63243 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 617 | 13 | 2 | 10 | 3.6 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCOC)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386757 | 63244 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 631 | 14 | 2 | 10 | 4.0 | CCOCCn1c(=O)c2c(CN(C)CCOC)c(-c3ccc(NC(=O)NOC)cc3)sc2n(Cc2c(F)cccc2F)c1=O | 10.1021/jm200216q | ||
CHEMBL1800670 | 63244 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 631 | 14 | 2 | 10 | 4.0 | CCOCCn1c(=O)c2c(CN(C)CCOC)c(-c3ccc(NC(=O)NOC)cc3)sc2n(Cc2c(F)cccc2F)c1=O | 10.1021/jm200216q | ||
44293348 | 100026 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL290991 | 100026 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293075 | 90233 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL239108 | 90233 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
18914263 | 96453 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL265774 | 96453 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44214108 | 100647 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295152 | 100647 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
21254068 | 101318 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL300045 | 101318 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293070 | 165542 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL42592 | 165542 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
18914272 | 169114 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL443768 | 169114 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
21254089 | 181075 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47761 | 181075 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292988 | 181859 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47862 | 181859 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
18914248 | 187148 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49542 | 187148 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
10794239 | 12953 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 643 | 11 | 1 | 7 | 7.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL1190107 | 12953 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 643 | 11 | 1 | 7 | 7.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL540109 | 12953 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 643 | 11 | 1 | 7 | 7.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
9809590 | 79227 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 641 | 11 | 1 | 6 | 8.1 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211503 | 79227 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 641 | 11 | 1 | 6 | 8.1 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
11643195 | 79419 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 2 | 7 | 7.2 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)(C)O)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL212121 | 79419 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 2 | 7 | 7.2 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)(C)O)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11628915 | 137697 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 629 | 11 | 2 | 7 | 6.5 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CO)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL377015 | 137697 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 629 | 11 | 2 | 7 | 6.5 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CO)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11512905 | 137890 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL377396 | 137890 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
118074127 | 175144 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 714 | 12 | 2 | 11 | 3.9 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4582367 | 175144 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 714 | 12 | 2 | 11 | 3.9 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44348308 | 81576 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL216519 | 81576 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
53387071 | 63190 | 4 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800157 | 63190 | 4 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 667 | 12 | 2 | 12 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
44346805 | 168288 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1565 | 40 | 20 | 23 | -2.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCNCc1cc(O)c2c(c1)C(=O)c1cc(C(=O)O)cc(O)c1C2=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm010112g | ||
91931800 | 168288 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1565 | 40 | 20 | 23 | -2.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCNCc1cc(O)c2c(c1)C(=O)c1cc(C(=O)O)cc(O)c1C2=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm010112g | ||
CHEMBL438099 | 168288 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1565 | 40 | 20 | 23 | -2.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCNCc1cc(O)c2c(c1)C(=O)c1cc(C(=O)O)cc(O)c1C2=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NOC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm010112g | ||
1175 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1039/C5MD00259A | ||||
1559 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1039/C5MD00259A | ||||
657181 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1039/C5MD00259A | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1039/C5MD00259A | ||||
DB00007 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1039/C5MD00259A | ||||
145958346 | 161432 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 543 | 8 | 1 | 7 | 4.3 | COc1ccc(F)cc1C(N)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4159155 | 161432 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 543 | 8 | 1 | 7 | 4.3 | COc1ccc(F)cc1C(N)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
10100930 | 63188 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800155 | 63188 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 12 | 2 | 10 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)cc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
10985312 | 78336 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21126 | 78336 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9896373 | 98592 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 694 | 11 | 1 | 8 | 7.4 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc(NC(=O)C(C)C)cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
CHEMBL280365 | 98592 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 694 | 11 | 1 | 8 | 7.4 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc(NC(=O)C(C)C)cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
44395623 | 124137 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 5.3 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL364167 | 124137 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 5.3 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
10053165 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL48192 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44321052 | 204548 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 9 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86912 | 204548 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 9 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44340906 | 9480 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 9 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL112400 | 9480 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 9 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
9985901 | 109964 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL324654 | 109964 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
53386758 | 63183 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 603 | 12 | 3 | 10 | 3.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCO)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800150 | 63183 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 603 | 12 | 3 | 10 | 3.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CCO)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386914 | 63184 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 631 | 12 | 3 | 10 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CC(C)(C)O)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800151 | 63184 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 631 | 12 | 3 | 10 | 3.8 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(CC(C)(C)O)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53389116 | 63239 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 672 | 11 | 2 | 11 | 4.6 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCn2ccnn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800665 | 63239 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 672 | 11 | 2 | 11 | 4.6 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCn2ccnn2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
9895596 | 63185 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800152 | 63185 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 636 | 11 | 2 | 10 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
53386915 | 63186 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800153 | 63186 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 650 | 11 | 2 | 10 | 4.7 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(C)cn1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
10009345 | 100452 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 642 | 11 | 2 | 8 | 5.8 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL293921 | 100452 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 642 | 11 | 2 | 8 | 5.8 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
44380643 | 58410 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 7.7 | COC(=O)c1nc2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4ccc(C(C)(C)C(=O)N5CC6CCC5CC6)cc34)ccc2[nH]1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168498 | 58410 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 7.7 | COC(=O)c1nc2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4ccc(C(C)(C)C(=O)N5CC6CCC5CC6)cc34)ccc2[nH]1 | 10.1016/s0960-894x(02)00026-4 | ||
44380625 | 58418 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168538 | 58418 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
10008768 | 58426 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168563 | 58426 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380488 | 58707 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ocnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169238 | 58707 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ocnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9894997 | 119808 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352806 | 119808 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 602 | 9 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44214098 | 100824 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296483 | 100824 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293443 | 183469 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48224 | 183469 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293148 | 186903 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 524 | 12 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49412 | 186903 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 524 | 12 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
9936150 | 188150 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50500 | 188150 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293054 | 101025 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297927 | 101025 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292977 | 173665 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45489 | 173665 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
1175 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
1559 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
657181 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
44348321 | 96081 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1520 | 39 | 15 | 17 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](NC(=O)c2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL262825 | 96081 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1520 | 39 | 15 | 17 | 2.3 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](NC(=O)c2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348306 | 156451 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL407316 | 156451 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348399 | 160778 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](NC(C)=O)N(C)C(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL412472 | 160778 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](NC(C)=O)N(C)C(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348528 | 161378 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL415351 | 161378 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
10053165 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48192 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/s0960-894x(00)00318-8 | ||
10053165 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL48192 | 183417 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
1175 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
1559 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
657181 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
67144164 | 173314 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 643 | 9 | 1 | 10 | 3.9 | COC(=O)c1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)o1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4539811 | 173314 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 643 | 9 | 1 | 10 | 3.9 | COC(=O)c1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)o1 | 10.1021/acs.jmedchem.6b01071 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44395435 | 123295 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 523 | 7 | 3 | 8 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL362371 | 123295 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 523 | 7 | 3 | 8 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
67143710 | 169768 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4447139 | 169768 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
10348973 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
10348973 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | - | 1 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
87285473 | 173518 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 663 | 8 | 1 | 7 | 5.6 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4544693 | 173518 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 663 | 8 | 1 | 7 | 5.6 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
145955571 | 162109 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169891 | 162109 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 721 | 13 | 2 | 9 | 5.2 | Cc1cc(F)cc([C@H](Cn2c(=O)c(N3CCN(Cc4ccc(C(F)(F)F)o4)CC3)c(C)n(Cc3c(F)cccc3F)c2=O)NCCCC(=O)O)c1 | 10.1016/j.ejmech.2017.12.095 | ||
10348973 | 3261 | 50 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5432 | 3261 | 50 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
5586 | 3261 | 50 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
DB11853 | 3261 | 50 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/jm200216q | ||
67144353 | 171657 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 673 | 9 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4474058 | 171657 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 673 | 9 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
145954246 | 161858 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 529 | 7 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4165983 | 161858 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 529 | 7 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44348533 | 161191 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL413752 | 161191 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
67143773 | 169937 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 619 | 8 | 1 | 8 | 4.8 | Cc1c(N2CCN(Cc3ccc(Cl)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449450 | 169937 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 619 | 8 | 1 | 8 | 4.8 | Cc1c(N2CCN(Cc3ccc(Cl)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143621 | 170737 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4460880 | 170737 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
87285554 | 172758 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4526641 | 172758 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9917618 | 98189 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 653 | 9 | 3 | 8 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NO)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm020180i | ||
CHEMBL277214 | 98189 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 653 | 9 | 3 | 8 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NO)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm020180i | ||
10919567 | 98573 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 664 | 10 | 1 | 7 | 7.4 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL280213 | 98573 | 0 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 664 | 10 | 1 | 7 | 7.4 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44321963 | 105461 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 622 | 11 | 2 | 5 | 6.8 | COCn1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccc1=O | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL312864 | 105461 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 622 | 11 | 2 | 5 | 6.8 | COCn1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccc1=O | 10.1016/s0960-894x(01)00512-1 | ||
44321411 | 106526 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@@H]5CC[C@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315326 | 106526 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@@H]5CC[C@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321345 | 204519 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 596 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCC2CCC(=O)N(C)C2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86758 | 204519 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 596 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCC2CCC(=O)N(C)C2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44293163 | 188115 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL50433 | 188115 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44341082 | 9685 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 590 | 9 | 2 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)nc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL113574 | 9685 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 590 | 9 | 2 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)nc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44341046 | 9981 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 634 | 11 | 2 | 5 | 7.5 | CC(=O)OCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL115365 | 9981 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 634 | 11 | 2 | 5 | 7.5 | CC(=O)OCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
44340888 | 110036 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 592 | 10 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(CO)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL325091 | 110036 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 592 | 10 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(CO)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
9895731 | 201746 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 644 | 11 | 2 | 9 | 5.4 | CONC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL65769 | 201746 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 644 | 11 | 2 | 9 | 5.4 | CONC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
9873212 | 57272 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 9 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166649 | 57272 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 9 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9938925 | 57287 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 616 | 11 | 3 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166763 | 57287 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 616 | 11 | 3 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2c[nH]c3ncnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380626 | 58419 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 587 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168539 | 58419 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 587 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380537 | 96113 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL263004 | 96113 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 9 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380394 | 119443 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL349638 | 119443 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380514 | 119707 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(=O)O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352051 | 119707 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(=O)O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9809394 | 120004 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 628 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL354524 | 120004 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 628 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44292940 | 100794 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296244 | 100794 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293651 | 162564 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417726 | 162564 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 510 | 10 | 2 | 4 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293335 | 172058 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL449351 | 172058 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293349 | 183542 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48273 | 183542 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 552 | 16 | 2 | 3 | 8.0 | CCCCN(CCCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
10258643 | 100913 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 644 | 16 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297151 | 100913 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 644 | 16 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293178 | 100952 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297430 | 100952 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293074 | 187200 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49578 | 187200 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
11614283 | 77771 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 627 | 11 | 1 | 6 | 7.9 | CCC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210321 | 77771 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 627 | 11 | 1 | 6 | 7.9 | CCC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11592777 | 138723 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 643 | 11 | 2 | 6 | 8.0 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL378979 | 138723 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 643 | 11 | 2 | 6 | 8.0 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
44413067 | 138770 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 593 | 11 | 1 | 7 | 6.9 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL379198 | 138770 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 593 | 11 | 1 | 7 | 6.9 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44352512 | 116796 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 483 | 7 | 3 | 7 | 4.7 | Cc1cc(-c2c(O)nc3ccc(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL339636 | 116796 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 483 | 7 | 3 | 7 | 4.7 | Cc1cc(-c2c(O)nc3ccc(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(01)00779-x | ||
67143509 | 169498 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4443108 | 169498 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44348324 | 156736 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL407681 | 156736 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44309572 | 202636 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71561 | 202636 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(02)00370-0 | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
87285768 | 169927 | 1 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm049218c | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm049218c | ||
67142732 | 169056 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 640 | 9 | 1 | 9 | 4.5 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436854 | 169056 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 640 | 9 | 1 | 9 | 4.5 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
145949496 | 162308 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173065 | 162308 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 685 | 13 | 2 | 9 | 4.9 | Cc1cccc(F)c1Cn1c(C)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL2370593 | 208131 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](N)C(N)=O)cc1 | 10.1021/jm970024p | ||||
44460342 | 167359 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 606 | 9 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL431402 | 167359 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 606 | 9 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)[n+]([O-])c(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
18324807 | 63242 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800668 | 63242 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 635 | 11 | 2 | 9 | 5.0 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
9809382 | 100208 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL292291 | 100208 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
44380538 | 58776 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 619 | 9 | 2 | 5 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169620 | 58776 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 619 | 9 | 2 | 5 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293591 | 101125 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298700 | 101125 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293129 | 181154 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL47772 | 181154 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 510 | 11 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293213 | 187218 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49590 | 187218 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293071 | 101130 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298748 | 101130 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293366 | 161662 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL416285 | 161662 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
1175 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
1559 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
657181 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
CHEMBL2370590 | 208129 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)CCNC(C)C)cc1 | 10.1021/jm970024p | ||||
44293205 | 183379 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)ccc1I | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48165 | 183379 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 643 | 7 | 3 | 7 | 6.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)ccc1I | 10.1016/s0960-894x(00)00318-8 | ||
44295699 | 100751 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL295948 | 100751 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
9828888 | 101355 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL300295 | 101355 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
1175 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
1559 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
657181 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
44348325 | 96161 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](NC(=O)c2ccc(NC(C)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL263358 | 96161 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@@H](NC(=O)[C@@H](NC(=O)c2ccc(NC(C)=O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL2370592 | 208130 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)CC(C)C)cc1 | 10.1021/jm970024p | ||||
44395462 | 167660 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL433594 | 167660 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
10371708 | 63191 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
CHEMBL1800158 | 63191 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 622 | 9 | 2 | 10 | 4.4 | CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OC)nc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm200216q | ||
155531714 | 175617 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
58239302 | 161441 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4159247 | 161441 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 577 | 12 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(C)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.ejmech.2017.12.095 | ||
44348454 | 156678 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 42 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](NC=O)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL407615 | 156678 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 42 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](NC=O)C(N)=O)cc1 | 10.1021/jm970024p | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(02)00370-0 | ||
9896737 | 82954 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 695 | 11 | 2 | 8 | 7.3 | CC(C)ONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21936 | 82954 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 695 | 11 | 2 | 8 | 7.3 | CC(C)ONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9893269 | 65964 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 532 | 7 | 2 | 7 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL184819 | 65964 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 532 | 7 | 2 | 7 | 6.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
10187208 | 66415 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 540 | 7 | 2 | 9 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2OCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185785 | 66415 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 540 | 7 | 2 | 9 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2OCCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44395533 | 66465 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 577 | 7 | 2 | 8 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CC3CCN2CC3)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185986 | 66465 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 577 | 7 | 2 | 8 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CC3CCN2CC3)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
10231401 | 1989 | 1 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
5584 | 1989 | 1 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL314260 | 1989 | 1 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1016/s0960-894x(01)00512-1 | ||
44321148 | 96360 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 622 | 11 | 2 | 5 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CC4)OCCO5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL265042 | 96360 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 622 | 11 | 2 | 5 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CC4)OCCO5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44320895 | 163710 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL421160 | 163710 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321393 | 204547 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 9 | 2 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)c(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86911 | 204547 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 9 | 2 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc(C)c(=O)n(C)c2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44340928 | 9652 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 10 | 3 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL113432 | 9652 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 10 | 3 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44340929 | 113003 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 604 | 10 | 2 | 4 | 7.7 | CC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL332049 | 113003 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 604 | 10 | 2 | 4 | 7.7 | CC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
67143618 | 169727 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 637 | 8 | 1 | 10 | 4.1 | Cc1c(N2CCN(Cc3cccc4nonc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446435 | 169727 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 637 | 8 | 1 | 10 | 4.1 | Cc1c(N2CCN(Cc3cccc4nonc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9960399 | 50271 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 603 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3nnnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL157412 | 50271 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 603 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2c[nH]c3nnnc-3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380512 | 57132 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 617 | 9 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165456 | 57132 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 617 | 9 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380236 | 58413 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 641 | 11 | 2 | 4 | 8.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168506 | 58413 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 641 | 11 | 2 | 4 | 8.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380796 | 58891 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170159 | 58891 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 598 | 9 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380798 | 59014 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 588 | 9 | 3 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170606 | 59014 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 588 | 9 | 3 | 4 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]nnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380536 | 119885 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 602 | 9 | 2 | 4 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL353395 | 119885 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 602 | 9 | 2 | 4 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3ncoc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293273 | 161543 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL416102 | 161543 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293592 | 162340 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417363 | 162340 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44292918 | 170849 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL44627 | 170849 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293134 | 186818 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49366 | 186818 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293411 | 188182 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50552 | 188182 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 494 | 10 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44412890 | 77907 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 607 | 11 | 1 | 7 | 7.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210888 | 77907 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 607 | 11 | 1 | 7 | 7.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44295753 | 186164 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 559 | 7 | 3 | 7 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C)N2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL48879 | 186164 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 559 | 7 | 3 | 7 | 6.5 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C)N2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm020180i | ||
44348453 | 96672 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 42 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](NC=O)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL267642 | 96672 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 42 | 15 | 17 | 2.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](NC=O)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348316 | 96083 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)c2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL262842 | 96083 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)c2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348148 | 156209 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1545 | 41 | 14 | 16 | 3.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL407058 | 156209 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1545 | 41 | 14 | 16 | 3.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348527 | 161284 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL414558 | 161284 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1532 | 40 | 14 | 16 | 3.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL2370594 | 208132 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(N)=O)N(C)C=O)cc1 | 10.1021/jm970024p | ||||
87285708 | 173333 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 749 | 13 | 2 | 8 | 6.1 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4540232 | 173333 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 749 | 13 | 2 | 8 | 6.1 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
155517188 | 169596 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1542 | 39 | 20 | 23 | -4.2 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
CHEMBL4444427 | 169596 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1542 | 39 | 20 | 23 | -4.2 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
44395502 | 165345 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 553 | 7 | 3 | 9 | 5.0 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2COCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL424991 | 165345 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 553 | 7 | 3 | 9 | 5.0 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2COCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
9808288 | 110993 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL327704 | 110993 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321498 | 204582 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87099 | 204582 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44341197 | 108548 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 587 | 9 | 2 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C#N)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL321258 | 108548 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 587 | 9 | 2 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C#N)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44341198 | 112559 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 10 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL331144 | 112559 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 620 | 10 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(C)(C)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44460343 | 203634 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 11 | 2 | 4 | 7.6 | COCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL79639 | 203634 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 606 | 11 | 2 | 4 | 7.6 | COCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44305285 | 100151 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 630 | 11 | 2 | 9 | 5.0 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NOC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL291896 | 100151 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 630 | 11 | 2 | 9 | 5.0 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NOC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
44380478 | 58447 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168637 | 58447 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380483 | 58766 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 635 | 9 | 4 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2F)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169569 | 58766 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 635 | 9 | 4 | 4 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2F)c1 | 10.1016/s0960-894x(02)00026-4 | ||
9808288 | 110993 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL327704 | 110993 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 8.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380513 | 119686 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 631 | 10 | 4 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(CO)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL351836 | 119686 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 631 | 10 | 4 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(CO)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44292919 | 100676 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295376 | 100676 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293650 | 161779 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL416470 | 161779 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293045 | 185242 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 543 | 7 | 3 | 7 | 5.7 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc4c(c3)CCC4)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48674 | 185242 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 543 | 7 | 3 | 7 | 5.7 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc4c(c3)CCC4)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
44293206 | 186606 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1ccc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL49230 | 186606 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1ccc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)cc1C | 10.1016/s0960-894x(00)00318-8 | ||
145955844 | 162142 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 527 | 7 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cc(C)cc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4170478 | 162142 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 527 | 7 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cc(C)cc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44348534 | 161277 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1533 | 37 | 16 | 17 | -0.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)NC(NC(=O)CN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
91935482 | 161277 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1533 | 37 | 16 | 17 | -0.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)NC(NC(=O)CN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL414469 | 161277 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1533 | 37 | 16 | 17 | -0.4 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)NC(NC(=O)CN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348307 | 161276 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)c2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL414468 | 161276 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)c2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44395491 | 123332 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL362544 | 123332 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCN2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44321412 | 204529 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86805 | 204529 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321290 | 204680 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87785 | 204680 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44341164 | 9473 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL112378 | 9473 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cc[n+]([O-])cc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44341056 | 114036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL333614 | 114036 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccncc2C)c1 | 10.1016/s0960-894x(02)00751-5 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
53386917 | 63189 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
CHEMBL1800156 | 63189 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 666 | 12 | 2 | 11 | 4.4 | COCCN(C)Cc1c(-c2ccc(NC(=O)NOC)cc2)sc2c1c(=O)n(-c1ccc(OC)nc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm200216q | ||
71449058 | 83985 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111955 | 83985 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2219718 | 83985 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44380222 | 57291 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 614 | 10 | 2 | 5 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166778 | 57291 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 614 | 10 | 2 | 5 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cnc3nccnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293605 | 100704 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295591 | 100704 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 468 | 10 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44292874 | 183258 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 616 | 13 | 3 | 4 | 7.2 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)(C)C | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL48069 | 183258 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 616 | 13 | 3 | 4 | 7.2 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)(C)C | 10.1016/s0960-894x(01)00274-8 | ||
1175 | 2266 | 38 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
1559 | 2266 | 38 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
657181 | 2266 | 38 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0512894 | ||||
1175 | 2266 | 38 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
1559 | 2266 | 38 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
657181 | 2266 | 38 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9803673 | ||||
44348056 | 159471 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1545 | 41 | 14 | 16 | 3.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL410798 | 159471 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1545 | 41 | 14 | 16 | 3.1 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348400 | 168128 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)NC(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL436683 | 168128 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)NC(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44395583 | 123827 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 524 | 7 | 2 | 8 | 5.8 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL363663 | 123827 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 524 | 7 | 2 | 8 | 5.8 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCO2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44341113 | 9828 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL114438 | 9828 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 576 | 9 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
44341199 | 112560 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 620 | 10 | 2 | 5 | 7.2 | COC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL331145 | 112560 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 620 | 10 | 2 | 5 | 7.2 | COC(=O)c1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44295755 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL2111956 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL52278 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44380681 | 58466 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 669 | 9 | 3 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(F)(F)F)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168726 | 58466 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 669 | 9 | 3 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(C(F)(F)F)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380147 | 119772 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352566 | 119772 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
20691661 | 79203 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211485 | 79203 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
44348057 | 96010 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1559 | 41 | 13 | 16 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL262309 | 96010 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1559 | 41 | 13 | 16 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL2370589 | 208128 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | CN[C@@H](NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(C)=O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(N)=O | 10.1021/jm970024p | ||||
44293222 | 175387 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL138464 | 175387 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45883 | 175387 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44295755 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL2111956 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL52278 | 192519 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
67143518 | 174302 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4563562 | 174302 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
87285476 | 170901 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 653 | 8 | 1 | 8 | 5.2 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4463476 | 170901 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 653 | 8 | 1 | 8 | 5.2 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11017929 | 98564 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 6.4 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc(N)cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
CHEMBL280170 | 98564 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 6.4 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc(N)cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm020180i | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm020180i | ||
44321101 | 96400 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL265288 | 96400 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321394 | 106456 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 592 | 10 | 2 | 4 | 7.5 | COc1ccc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)cn1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL314860 | 106456 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 592 | 10 | 2 | 4 | 7.5 | COc1ccc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)cn1 | 10.1016/s0960-894x(01)00512-1 | ||
44321410 | 106525 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315325 | 106525 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 576 | 11 | 2 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
87285565 | 169702 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 679 | 9 | 1 | 8 | 5.4 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446131 | 169702 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 679 | 9 | 1 | 8 | 5.4 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143755 | 174853 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4576169 | 174853 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44293377 | 101433 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300865 | 101433 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 576 | 12 | 2 | 3 | 7.8 | CCC(C)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293347 | 162561 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417720 | 162561 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 550 | 11 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC(C)(C)C4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44412945 | 96258 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 641 | 11 | 1 | 7 | 7.8 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)c4ccccc4)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL264121 | 96258 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 641 | 11 | 1 | 7 | 7.8 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)c4ccccc4)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44293386 | 174959 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 571 | 7 | 3 | 7 | 6.5 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL45784 | 174959 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 571 | 7 | 3 | 7 | 6.5 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc(Cl)c(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
67143613 | 170459 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cccnc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4456703 | 170459 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cccnc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
22129998 | 100805 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL296321 | 100805 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
87285570 | 170175 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4452347 | 170175 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
67143804 | 172625 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 724 | 13 | 3 | 9 | 4.1 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4522657 | 172625 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 724 | 13 | 3 | 9 | 4.1 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
87285767 | 174305 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 775 | 13 | 2 | 10 | 5.1 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCS(=O)(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4563686 | 174305 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 775 | 13 | 2 | 10 | 5.1 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCS(=O)(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44380146 | 119771 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 627 | 10 | 2 | 4 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352565 | 119771 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 627 | 10 | 2 | 4 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccnc3nc(C)ccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380318 | 119873 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL353308 | 119873 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380487 | 167018 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]ncc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL430069 | 167018 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 601 | 9 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]ncc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44292950 | 161895 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL416651 | 161895 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cnccn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44292868 | 176333 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 571 | 7 | 3 | 7 | 6.5 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46177 | 176333 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 571 | 7 | 3 | 7 | 6.5 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
67143547 | 170950 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4464132 | 170950 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44320921 | 106685 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL316362 | 106685 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 548 | 9 | 2 | 3 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CC[C@@H]4C5)cc3c2[C@H](C)CNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
67143761 | 170795 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 710 | 12 | 3 | 9 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4461692 | 170795 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 710 | 12 | 3 | 9 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
87285550 | 173756 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 775 | 13 | 3 | 9 | 5.4 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCP(=O)(O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4550720 | 173756 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 775 | 13 | 3 | 9 | 5.4 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCP(=O)(O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44293555 | 100740 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 574 | 11 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C4(C(=O)N5C6CCC5CC6)CCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295897 | 100740 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 574 | 11 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C4(C(=O)N5C6CCC5CC6)CCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44348297 | 166906 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(Cl)cc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL429902 | 166906 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(Cl)cc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
145953172 | 161922 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 563 | 7 | 1 | 6 | 5.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cc(Cl)cc(Cl)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4167067 | 161922 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 563 | 7 | 1 | 6 | 5.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cc(Cl)cc(Cl)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL415547 | 211441 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||||
67143505 | 171664 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 601 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4474116 | 171664 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 601 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44321146 | 105924 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 592 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC(C)(C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313946 | 105924 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 592 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC(C)(C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL415547 | 211441 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@H](Cc1ccc(Nc2n[nH]c(N)n2)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||||
44395677 | 66405 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 565 | 7 | 2 | 8 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185738 | 66405 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 565 | 7 | 2 | 8 | 5.7 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCC[C@H]2CCC(=O)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44293249 | 184861 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL48616 | 184861 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321509 | 204468 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CCCC[C@H]5C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86431 | 204468 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C[C@H]5CCCC[C@H]5C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44359285 | 11522 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180695 | 11522 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138747 | 11522 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 565 | 7 | 3 | 7 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(Cl)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293249 | 184861 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48616 | 184861 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44215053 | 185038 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48641 | 185038 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 562 | 11 | 2 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44348149 | 168153 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)c2ccncc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL436897 | 168153 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)c2ccncc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
67143570 | 171191 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 726 | 14 | 2 | 10 | 5.0 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4467407 | 171191 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 726 | 14 | 2 | 10 | 5.0 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
23656390 | 161134 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1021/jm701249f | ||
CHEMBL413245 | 161134 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1021/jm701249f | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
67142962 | 174004 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 629 | 9 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4556717 | 174004 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 629 | 9 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44380797 | 58980 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL170499 | 58980 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3cnccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44215055 | 100820 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296442 | 100820 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 576 | 11 | 1 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(C)CCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44593425 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1021/jm701249f | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1021/jm701249f | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm200216q | ||
70689073 | 77273 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
91900370 | 77273 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2088253 | 77273 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
155531714 | 175617 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
10231401 | 1989 | 1 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1021/jm701249f | ||
5584 | 1989 | 1 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1021/jm701249f | ||
CHEMBL314260 | 1989 | 1 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 562 | 9 | 2 | 3 | 7.5 | Cc1cc(C)cc(c1)c1[nH]c2c(c1[C@@H](CNCCc1ccncc1)C)cc(cc2)C(C(=O)N1CC2CCC1CC2)(C)C | 10.1021/jm701249f | ||
44593425 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
44593425 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
67144370 | 174043 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4557575 | 174043 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44293488 | 101084 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298366 | 101084 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293376 | 101205 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299301 | 101205 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 590 | 13 | 2 | 3 | 8.2 | CCC(CC)(C(=O)N1C2CCC1CC2)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44348172 | 155211 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1547 | 39 | 14 | 17 | 1.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(C)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL405736 | 155211 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1547 | 39 | 14 | 17 | 1.8 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(C)=O)cc1 | 10.1021/jm970024p | ||
44402640 | 161281 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1617 | 41 | 17 | 17 | 2.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C2CCNC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL414514 | 161281 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 1617 | 41 | 17 | 17 | 2.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C2CCNC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
87285770 | 175470 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 803 | 15 | 2 | 10 | 6.4 | CCOP(=O)(O)CCCN[C@@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4590493 | 175470 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 803 | 15 | 2 | 10 | 6.4 | CCOP(=O)(O)CCCN[C@@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/acs.jmedchem.6b01071 | ||
11620431 | 178789 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL473807 | 178789 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44359264 | 11523 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180700 | 11523 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138866 | 11523 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293802 | 101562 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL301802 | 101562 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 550 | 11 | 2 | 3 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293081 | 182122 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL47895 | 182122 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44402639 | 154690 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1603 | 41 | 16 | 17 | 2.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CCC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL402671 | 154690 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1603 | 41 | 16 | 17 | 2.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CCC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
164628446 | 185730 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1627 | 43 | 20 | 26 | -5.2 | CC(C)CC(NC(=O)C(CCCCNC(=O)/C=N/OCC(=O)OCC1OC(n2ccc(N)nc2=O)C(F)(F)C1O)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1cc2ccccc2[nH]1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C1CCC(=O)N1)C(=O)NC(CCCNC(=N)N)C(=O)N1CCCC1C(=O)NCC(N)=O | 10.1016/j.ejmech.2020.113018 | ||
CHEMBL4874610 | 185730 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1627 | 43 | 20 | 26 | -5.2 | CC(C)CC(NC(=O)C(CCCCNC(=O)/C=N/OCC(=O)OCC1OC(n2ccc(N)nc2=O)C(F)(F)C1O)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1cc2ccccc2[nH]1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C1CCC(=O)N1)C(=O)NC(CCCNC(=N)N)C(=O)N1CCCC1C(=O)NCC(N)=O | 10.1016/j.ejmech.2020.113018 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
10438167 | 100712 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295641 | 100712 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 578 | 12 | 2 | 3 | 8.6 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44380319 | 58442 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168615 | 58442 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44348174 | 159497 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm970024p | ||
CHEMBL410818 | 159497 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm970024p | ||
67143612 | 170483 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 638 | 9 | 2 | 8 | 3.6 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4456937 | 170483 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 638 | 9 | 2 | 8 | 3.6 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44402639 | 154690 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1603 | 41 | 16 | 17 | 2.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CCC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL402671 | 154690 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1603 | 41 | 16 | 17 | 2.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CCC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
44402518 | 157980 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL409138 | 157980 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
44402640 | 161281 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1617 | 41 | 17 | 17 | 2.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C2CCNC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL414514 | 161281 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1617 | 41 | 17 | 17 | 2.0 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C2CCNC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||
91810333 | 178998 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 595 | 7 | 1 | 4 | 5.4 | C=CCC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCN(C(C)=O)CC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4741994 | 178998 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 595 | 7 | 1 | 4 | 5.4 | C=CCC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCN(C(C)=O)CC2 | 10.1021/acs.jmedchem.0c01076 | ||
118179218 | 179435 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 5.1 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccc(F)c3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4747248 | 179435 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 5.1 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccc(F)c3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
10004181 | 100617 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL294910 | 100617 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44573110 | 186611 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492327 | 186611 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
44573113 | 192635 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523711 | 192635 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44577104 | 178169 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL468565 | 178169 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
67143054 | 169721 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 581 | 8 | 1 | 7 | 3.9 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446360 | 169721 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 581 | 8 | 1 | 7 | 3.9 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
53239181 | 171937 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4483419 | 171937 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44305605 | 201640 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 613 | 11 | 1 | 8 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL64920 | 201640 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 613 | 11 | 1 | 8 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
11214294 | 121681 | 0 | None | 912 | 2 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL359754 | 121681 | 0 | None | 912 | 2 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL438652 | 212037 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(N)=O | 10.1021/jm0512894 | ||||
44293111 | 100748 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL295917 | 100748 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
10004181 | 100617 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL294910 | 100617 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
15895698 | 205152 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL90725 | 205152 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
11980076 | 206711 | 27 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
CHEMBL1007 | 206711 | 27 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL448249 | 212205 | 13 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44359456 | 12098 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184286 | 12098 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342908 | 12098 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 572 | 8 | 3 | 6 | 7.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccc(N(C)C)cc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44322384 | 105659 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 441 | 6 | 2 | 6 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL313501 | 105659 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 441 | 6 | 2 | 6 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44365638 | 41680 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 518 | 12 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(OCc4ccccc4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149441 | 41680 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 518 | 12 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(OCc4ccccc4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
44214104 | 121242 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 540 | 10 | 4 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCNCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL358901 | 121242 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 540 | 10 | 4 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCNCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
44444617 | 93711 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249372 | 93711 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322165 | 204495 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 458 | 5 | 1 | 4 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(C(F)(F)F)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL86609 | 204495 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 458 | 5 | 1 | 4 | 6.5 | Cc1cc(C)cc(-c2c(O)nc3cc(C(F)(F)F)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
11599857 | 76525 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 597 | 11 | 0 | 9 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2[N+](=O)[O-])c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL206964 | 76525 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 597 | 11 | 0 | 9 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2[N+](=O)[O-])c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11520078 | 79315 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 577 | 10 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2C#N)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL211588 | 79315 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 577 | 10 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2C#N)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44365131 | 38287 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 472 | 13 | 3 | 4 | 6.5 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL146451 | 38287 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 472 | 13 | 3 | 4 | 6.5 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44364998 | 40212 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 443 | 11 | 3 | 4 | 5.6 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL148246 | 40212 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 443 | 11 | 3 | 4 | 5.6 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
10808668 | 204894 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 362 | 4 | 1 | 4 | 5.2 | Oc1nc2cc(Cl)ccc2c(OCc2ccccn2)c1-c1ccccc1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89086 | 204894 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 362 | 4 | 1 | 4 | 5.2 | Oc1nc2cc(Cl)ccc2c(OCc2ccccn2)c1-c1ccccc1 | 10.1016/s0960-894x(99)00446-1 | ||
10837806 | 77672 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 463 | 7 | 0 | 7 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(C)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL209836 | 77672 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 463 | 7 | 0 | 7 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(C)c2c1=O | 10.1021/jm0512894 | ||
162653870 | 179961 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 489 | 4 | 1 | 4 | 3.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(C)(=O)=O)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4753775 | 179961 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 489 | 4 | 1 | 4 | 3.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(C)(=O)=O)C2C | 10.1021/acs.jmedchem.0c01076 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44444642 | 93934 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250770 | 93934 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67142732 | 169056 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 640 | 9 | 1 | 9 | 4.5 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436854 | 169056 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 640 | 9 | 1 | 9 | 4.5 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
67143815 | 170974 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 651 | 8 | 1 | 8 | 5.8 | Cc1c(N2CCN(Cc3cccc4ccsc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4464440 | 170974 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 651 | 8 | 1 | 8 | 5.8 | Cc1c(N2CCN(Cc3cccc4ccsc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143102 | 172363 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 610 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C#N)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4516712 | 172363 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 610 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3ccc(C#N)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
71623059 | 180243 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4756920 | 180243 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44444645 | 154461 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401351 | 154461 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
162673323 | 182534 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccccc4Cl)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4794864 | 182534 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccccc4Cl)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
86274853 | 115687 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 662 | 6 | 1 | 7 | 4.5 | N#Cc1cccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ncc(C(F)(F)F)cc4F)cc3C3(CCS(=O)(=O)CC3)C2C2CC2)c1 | 10.1021/ml5004469 | ||
CHEMBL3358414 | 115687 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 662 | 6 | 1 | 7 | 4.5 | N#Cc1cccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ncc(C(F)(F)F)cc4F)cc3C3(CCS(=O)(=O)CC3)C2C2CC2)c1 | 10.1021/ml5004469 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
67143030 | 172546 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 638 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(F)c3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4520639 | 172546 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 638 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(F)c3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44444668 | 153745 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL398648 | 153745 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143633 | 172738 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 8 | 2 | 8 | 3.2 | Cc1c(N2CCN(Cc3ccc(=O)[nH]c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4526188 | 172738 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 8 | 2 | 8 | 3.2 | Cc1c(N2CCN(Cc3ccc(=O)[nH]c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL2370265 | 208080 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm990433g | ||||
44573275 | 186832 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.6 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1CC | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493730 | 186832 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.6 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1CC | 10.1016/j.bmcl.2009.02.043 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44293151 | 100705 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295595 | 100705 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 510 | 12 | 2 | 3 | 6.9 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00275-x | ||
44293250 | 101263 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299615 | 101263 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 552 | 11 | 2 | 4 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
145973124 | 162472 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 595 | 8 | 1 | 6 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3ccc(C(F)(F)F)cc3F)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4175801 | 162472 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 595 | 8 | 1 | 6 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3ccc(C(F)(F)F)cc3F)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL409218 | 211006 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
11496945 | 175901 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459659 | 175901 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
21899433 | 154164 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399772 | 154164 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44359193 | 11533 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180764 | 11533 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141750 | 11533 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 587 | 8 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)NCc4ccc5c(c4)OCO5)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44402335 | 71272 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 470 | 8 | 1 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)CC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196337 | 71272 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 470 | 8 | 1 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)CC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402468 | 132299 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370144 | 132299 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
70697569 | 77620 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.6 | CC(C)(C)CNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL2096778 | 77620 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.6 | CC(C)(C)CNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
11720984 | 63149 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 555 | 9 | 3 | 5 | 4.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL179885 | 63149 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 555 | 9 | 3 | 5 | 4.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391541 | 65260 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 482 | 9 | 1 | 7 | 4.6 | CCSc1nc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183237 | 65260 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 482 | 9 | 1 | 7 | 4.6 | CCSc1nc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44391525 | 165813 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(OC)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL427500 | 165813 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(OC)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365375 | 121002 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 402 | 9 | 3 | 2 | 5.8 | Oc1ccc(CCCCNCCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL358416 | 121002 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 402 | 9 | 3 | 2 | 5.8 | Oc1ccc(CCCCNCCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
11619758 | 172643 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 470 | 6 | 3 | 5 | 5.0 | S=c1[nH]c2cccc(OCCN3CCN(c4cccc5[nH]c(-c6ccccc6)nc45)CC3)c2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452293 | 172643 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 470 | 6 | 3 | 5 | 5.0 | S=c1[nH]c2cccc(OCCN3CCN(c4cccc5[nH]c(-c6ccccc6)nc45)CC3)c2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
67144335 | 169271 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 658 | 9 | 1 | 9 | 4.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4439926 | 169271 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 658 | 9 | 1 | 9 | 4.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
118179127 | 182632 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 599 | 7 | 2 | 5 | 4.2 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2CCO | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4795998 | 182632 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 599 | 7 | 2 | 5 | 4.2 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2CCO | 10.1021/acs.jmedchem.0c01076 | ||
44444676 | 154399 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401080 | 154399 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444641 | 154430 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401212 | 154430 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143413 | 169050 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1cncc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436711 | 169050 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1cncc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
44365877 | 118975 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 646 | 13 | 3 | 6 | 6.2 | CCCS(=O)(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL345297 | 118975 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 646 | 13 | 3 | 6 | 6.2 | CCCS(=O)(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
44573789 | 186757 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493167 | 186757 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
11496610 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
5582 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL474991 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
11532637 | 7633 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1088866 | 7633 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
53238728 | 170107 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 545 | 8 | 1 | 7 | 3.7 | Cc1c(N2CCN(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4451627 | 170107 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 545 | 8 | 1 | 7 | 3.7 | Cc1c(N2CCN(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
11496610 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
5582 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
CHEMBL474991 | 4012 | 11 | None | - | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44391752 | 161113 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL413062 | 161113 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
87285476 | 170901 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 653 | 8 | 1 | 8 | 5.2 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4463476 | 170901 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 653 | 8 | 1 | 8 | 5.2 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44573278 | 186864 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493932 | 186864 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
44573628 | 192614 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 473 | 5 | 1 | 5 | 6.2 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523527 | 192614 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 473 | 5 | 1 | 5 | 6.2 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
25194091 | 188423 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL508898 | 188423 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
25193797 | 189073 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL515200 | 189073 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44267232 | 9526 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 10 | 3 | 3 | 6.0 | CC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cn1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11263 | 9526 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 10 | 3 | 3 | 6.0 | CC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cn1 | 10.1016/s0960-894x(01)00133-0 | ||
44402647 | 69486 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 604 | 11 | 3 | 8 | 6.5 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193740 | 69486 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 604 | 11 | 3 | 8 | 6.5 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
11525693 | 69487 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 471 | 8 | 2 | 7 | 5.6 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193749 | 69487 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 471 | 8 | 2 | 7 | 5.6 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
11237922 | 65189 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
11237922 | 65189 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183066 | 65189 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183066 | 65189 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
25194092 | 189284 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 6 | 3 | 5 | 5.6 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)c(C)c1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL516934 | 189284 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 6 | 3 | 5 | 5.6 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)c(C)c1 | 10.1016/j.bmc.2008.05.024 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391541 | 65260 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 9 | 1 | 7 | 4.6 | CCSc1nc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183237 | 65260 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 482 | 9 | 1 | 7 | 4.6 | CCSc1nc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
87285767 | 174305 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 775 | 13 | 2 | 10 | 5.1 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCS(=O)(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4563686 | 174305 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 775 | 13 | 2 | 10 | 5.1 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCS(=O)(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44267270 | 10280 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 450 | 9 | 2 | 1 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc3c(c2)CCCC3)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11623 | 10280 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 450 | 9 | 2 | 1 | 7.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc3c(c2)CCCC3)c1 | 10.1016/s0960-894x(01)00133-0 | ||
162652474 | 179869 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 519 | 5 | 1 | 3 | 5.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(Cc1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4752711 | 179869 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 519 | 5 | 1 | 3 | 5.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(Cc1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
67144367 | 169295 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 6 | 1 | 6 | 3.3 | Cc1c(N2CCCCC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4440296 | 169295 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 6 | 1 | 6 | 3.3 | Cc1c(N2CCCCC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
87285768 | 169927 | 1 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
162650892 | 179649 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749974 | 179649 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
67144085 | 170604 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4458877 | 170604 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
67144307 | 172458 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 8 | 1 | 8 | 3.1 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4518726 | 172458 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 546 | 8 | 1 | 8 | 3.1 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44365486 | 38882 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 434 | 9 | 3 | 2 | 6.8 | Oc1ccc(CCCCNCCc2c(-c3cccc4ccccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL146921 | 38882 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 434 | 9 | 3 | 2 | 6.8 | Oc1ccc(CCCCNCCc2c(-c3cccc4ccccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL329807 | 209574 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
CHEMBL408737 | 210981 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N[C@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44402467 | 170089 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL445143 | 170089 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402647 | 69486 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 604 | 11 | 3 | 8 | 6.5 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193740 | 69486 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 604 | 11 | 3 | 8 | 6.5 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44365119 | 119145 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 384 | 9 | 3 | 2 | 5.7 | Oc1ccc(CCCCNCCc2c(-c3ccccc3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL346852 | 119145 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 384 | 9 | 3 | 2 | 5.7 | Oc1ccc(CCCCNCCc2c(-c3ccccc3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
25194090 | 188341 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 484 | 6 | 3 | 5 | 5.3 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL507973 | 188341 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 484 | 6 | 3 | 5 | 5.3 | Cc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322240 | 204685 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OC2CCN(C)CC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL87804 | 204685 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 396 | 3 | 1 | 4 | 5.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OC2CCN(C)CC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44322436 | 204938 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 424 | 4 | 1 | 4 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89387 | 204938 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 424 | 4 | 1 | 4 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
123549935 | 178854 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 4.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccccc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740379 | 178854 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 4.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccccc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
162647697 | 179279 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 523 | 5 | 1 | 5 | 5.2 | O=C(Nc1ccc2c(c1)C1(CCSCC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4745391 | 179279 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 523 | 5 | 1 | 5 | 5.2 | O=C(Nc1ccc2c(c1)C1(CCSCC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
44444665 | 93767 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249772 | 93767 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL2430899 | 208715 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.bmcl.2013.08.075 | ||||
118179265 | 179931 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 619 | 5 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(C(F)(F)F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4753358 | 179931 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 619 | 5 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(C(F)(F)F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
118178983 | 182849 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 552 | 5 | 1 | 5 | 4.1 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1cccnc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4798682 | 182849 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 552 | 5 | 1 | 5 | 4.1 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1cccnc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44328452 | 96002 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 1072 | 26 | 9 | 12 | 1.9 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N[C@H](CCCCNNC(=O)c1cccnc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
CHEMBL262190 | 96002 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 1072 | 26 | 9 | 12 | 1.9 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N[C@H](CCCCNNC(=O)c1cccnc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
53238731 | 170409 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4456075 | 170409 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44214070 | 178594 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 561 | 13 | 3 | 5 | 6.2 | CCOC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47227 | 178594 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 561 | 13 | 3 | 5 | 6.2 | CCOC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44391808 | 65264 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 587 | 9 | 3 | 5 | 5.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3Cl)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183274 | 65264 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 587 | 9 | 3 | 5 | 5.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3Cl)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
67144408 | 175336 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 586 | 8 | 1 | 9 | 3.5 | Cc1c(N2CCN(Cc3ccon3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4587044 | 175336 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 586 | 8 | 1 | 9 | 3.5 | Cc1c(N2CCN(Cc3ccon3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67144409 | 170539 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cn1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4457786 | 170539 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cn1 | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67144509 | 173557 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 575 | 9 | 1 | 8 | 3.7 | COc1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4546034 | 173557 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 575 | 9 | 1 | 8 | 3.7 | COc1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
162672599 | 182425 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 481 | 4 | 1 | 5 | 4.1 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(NC(=O)c3cccnc3)cc2C12CCOCC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4793643 | 182425 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 481 | 4 | 1 | 5 | 4.1 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(NC(=O)c3cccnc3)cc2C12CCOCC2 | 10.1021/acs.jmedchem.0c01076 | ||
44328414 | 96008 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1028 | 23 | 9 | 10 | 2.2 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)Nc1ccccc1C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
CHEMBL262292 | 96008 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1028 | 23 | 9 | 10 | 2.2 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)Nc1ccccc1C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
44402404 | 133041 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 568 | 9 | 2 | 8 | 5.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N3CCCC3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL371073 | 133041 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 568 | 9 | 2 | 8 | 5.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N3CCCC3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
11237922 | 65189 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
11237922 | 65189 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183066 | 65189 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183066 | 65189 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1cccnc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322077 | 204817 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 421 | 5 | 1 | 6 | 4.9 | Cc1cc(C)cc(-c2c(O)nc3cc([N+](=O)[O-])ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL88620 | 204817 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 421 | 5 | 1 | 6 | 4.9 | Cc1cc(C)cc(-c2c(O)nc3cc([N+](=O)[O-])ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44322441 | 205081 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CN(C)CCO2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL90383 | 205081 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CN(C)CCO2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44391574 | 65759 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 4.2 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccsc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183847 | 65759 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 4.2 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccsc1 | 10.1016/j.bmcl.2004.10.089 | ||
162667361 | 181943 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4787218 | 181943 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44322399 | 204556 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 7 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCCC2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL86955 | 204556 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 7 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCCC2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
71666542 | 179767 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 621 | 6 | 1 | 6 | 4.4 | O=C(NCc1ncc(F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4751345 | 179767 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 621 | 6 | 1 | 6 | 4.4 | O=C(NCc1ncc(F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
67143761 | 170795 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 710 | 12 | 3 | 9 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4461692 | 170795 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 710 | 12 | 3 | 9 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
118179051 | 179638 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44322440 | 111071 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 6 | 2 | 6 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL328063 | 111071 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 6 | 2 | 6 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44365626 | 205215 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 596 | 11 | 3 | 5 | 6.4 | CCC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL91146 | 205215 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 596 | 11 | 3 | 5 | 6.4 | CCC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
9918188 | 154183 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399856 | 154183 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44359252 | 11526 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180715 | 11526 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139291 | 11526 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 571 | 8 | 3 | 7 | 6.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccnc(C5CC5)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
71461676 | 79089 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCC[C@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL2113717 | 79089 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCC[C@H](C)N2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44380192 | 57146 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165534 | 57146 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
70691931 | 73840 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1924 | 45 | 22 | 28 | -1.5 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2023088 | 73840 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1924 | 45 | 22 | 28 | -1.5 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
15895698 | 205152 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL90725 | 205152 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44322166 | 204542 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Br)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL86897 | 204542 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 5 | 1 | 4 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Br)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
20691661 | 79203 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211485 | 79203 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 657 | 12 | 2 | 7 | 7.2 | CCC(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
9909560 | 9781 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 411 | 10 | 2 | 2 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11420 | 9781 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 411 | 10 | 2 | 2 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402492 | 125663 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1cccnc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364933 | 125663 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1cccnc1 | 10.1016/j.bmcl.2005.03.030 | ||
44391718 | 65274 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 523 | 10 | 3 | 5 | 4.0 | CC(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183325 | 65274 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 523 | 10 | 3 | 5 | 4.0 | CC(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44365093 | 118756 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 9 | 3 | 2 | 7.7 | Oc1ccc(CCCCNCCc2c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL343658 | 118756 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 9 | 3 | 2 | 7.7 | Oc1ccc(CCCCNCCc2c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
162645007 | 178881 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL264526 | 208880 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44560995 | 178574 | 0 | None | - | 3 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL472117 | 178574 | 0 | None | - | 3 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402232 | 71067 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 454 | 8 | 1 | 7 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CCC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195920 | 71067 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 454 | 8 | 1 | 7 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CCC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402072 | 71395 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 442 | 8 | 1 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196616 | 71395 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 442 | 8 | 1 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44561265 | 172538 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 5.0 | FC(F)(F)C(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452044 | 172538 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 5.0 | FC(F)(F)C(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44560995 | 178574 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL472117 | 178574 | 0 | None | - | 3 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 498 | 5 | 2 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
67143374 | 171175 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cncc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4467261 | 171175 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cncc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
162645007 | 178881 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
162675445 | 182826 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4798298 | 182826 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44444647 | 154462 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401352 | 154462 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
71668147 | 179410 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 637 | 6 | 1 | 6 | 4.6 | O=C(NCc1ccc(C(F)(F)F)cn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4746969 | 179410 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 637 | 6 | 1 | 6 | 4.6 | O=C(NCc1ccc(C(F)(F)F)cn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
86275342 | 115686 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL3358413 | 115686 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44365793 | 120864 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 499 | 11 | 4 | 4 | 6.4 | CCNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL358126 | 120864 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 499 | 11 | 4 | 4 | 6.4 | CCNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL97540 | 214149 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44444635 | 154166 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399779 | 154166 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
145957339 | 161759 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 561 | 8 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3c(F)cccc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4164508 | 161759 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 561 | 8 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3c(F)cccc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44572286 | 180219 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475650 | 180219 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
10046374 | 9067 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL11009 | 9067 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
10046374 | 9067 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11009 | 9067 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67143780 | 171686 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 637 | 9 | 1 | 8 | 4.7 | CC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4474379 | 171686 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 637 | 9 | 1 | 8 | 4.7 | CC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44380624 | 58826 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 587 | 8 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL169873 | 58826 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 587 | 8 | 3 | 3 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCc2ccc3[nH]cnc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
56655880 | 73839 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1841 | 41 | 22 | 28 | -2.8 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2023087 | 73839 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1841 | 41 | 22 | 28 | -2.8 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
70689073 | 77273 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
91900370 | 77273 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2088253 | 77273 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1835 | 43 | 23 | 28 | -2.7 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44267237 | 97921 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL275287 | 97921 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402560 | 71092 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 429 | 7 | 1 | 5 | 5.9 | COc1ccc(Cl)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196088 | 71092 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 429 | 7 | 1 | 5 | 5.9 | COc1ccc(Cl)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402468 | 132299 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370144 | 132299 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402256 | 135756 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 519 | 8 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL373340 | 135756 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 519 | 8 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
11330164 | 64872 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 540 | 10 | 1 | 7 | 4.1 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL182513 | 64872 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 540 | 10 | 1 | 7 | 4.1 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402426 | 132236 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 8 | 2 | 7 | 5.1 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370028 | 132236 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 8 | 2 | 7 | 5.1 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391849 | 122439 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 435 | 7 | 1 | 4 | 4.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(C1CC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL360743 | 122439 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 435 | 7 | 1 | 4 | 4.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(C1CC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
162673323 | 182534 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccccc4Cl)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4794864 | 182534 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccccc4Cl)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
21899433 | 154164 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399772 | 154164 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 631 | 8 | 1 | 6 | 5.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67143135 | 173950 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3nccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4555444 | 173950 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3nccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44444670 | 94043 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251388 | 94043 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67144409 | 170539 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cn1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4457786 | 170539 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cn1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL268720 | 209018 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44572235 | 188917 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
CHEMBL513998 | 188917 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
145955182 | 161862 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 7 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccs3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4166009 | 161862 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 7 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccs3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44593425 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmc.2008.05.024 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67143135 | 173950 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3nccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4555444 | 173950 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3nccs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44365087 | 38613 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 452 | 9 | 3 | 2 | 7.0 | Oc1ccc(CCCCNCCc2c(-c3cc(Cl)cc(Cl)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL146693 | 38613 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 452 | 9 | 3 | 2 | 7.0 | Oc1ccc(CCCCNCCc2c(-c3cc(Cl)cc(Cl)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
67143397 | 171580 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 652 | 9 | 2 | 8 | 3.9 | CNC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4473168 | 171580 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 652 | 9 | 2 | 8 | 3.9 | CNC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
10074296 | 9298 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00779-x | ||
44444642 | 93934 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250770 | 93934 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 629 | 8 | 1 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
10074296 | 9298 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
10074296 | 9298 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402469 | 71334 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 599 | 13 | 3 | 9 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196439 | 71334 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 599 | 13 | 3 | 9 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402463 | 127002 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 5.2 | CCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL366236 | 127002 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 5.2 | CCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
11720984 | 63149 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 555 | 9 | 3 | 5 | 4.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL179885 | 63149 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 555 | 9 | 3 | 5 | 4.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
11330164 | 64872 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 540 | 10 | 1 | 7 | 4.1 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL182513 | 64872 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 540 | 10 | 1 | 7 | 4.1 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365280 | 120623 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cccc(C)c1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL357622 | 120623 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cccc(C)c1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44348265 | 166747 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 1529 | 40 | 15 | 19 | 0.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)c2cnccn2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL429381 | 166747 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 1529 | 40 | 15 | 19 | 0.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)c2cnccn2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
118167818 | 178852 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740373 | 178852 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
44444639 | 154428 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401193 | 154428 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444672 | 168836 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL442283 | 168836 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
118178986 | 181617 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 555 | 5 | 1 | 4 | 4.5 | CC(=O)N1CCC2(CC1)CN(S(=O)(=O)c1ccc(F)cc1)c1ccc(C(=O)NCc3ccccc3Cl)cc12 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4782882 | 181617 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 555 | 5 | 1 | 4 | 4.5 | CC(=O)N1CCC2(CC1)CN(S(=O)(=O)c1ccc(F)cc1)c1ccc(C(=O)NCc3ccccc3Cl)cc12 | 10.1021/acs.jmedchem.0c01076 | ||
44444639 | 154428 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401193 | 154428 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 589 | 8 | 1 | 5 | 5.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N(C)C)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143773 | 169937 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 619 | 8 | 1 | 8 | 4.8 | Cc1c(N2CCN(Cc3ccc(Cl)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449450 | 169937 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 619 | 8 | 1 | 8 | 4.8 | Cc1c(N2CCN(Cc3ccc(Cl)o3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44444652 | 94066 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251578 | 94066 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
162651368 | 179756 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 533 | 4 | 1 | 3 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(C(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4751238 | 179756 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 533 | 4 | 1 | 3 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(C(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
162660654 | 180718 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 4.2 | O=C(Nc1ccc2c(c1)C1(CC[S+]([O-])CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4762368 | 180718 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 4.2 | O=C(Nc1ccc2c(c1)C1(CC[S+]([O-])CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
118179218 | 179435 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 5.1 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccc(F)c3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4747248 | 179435 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 565 | 5 | 1 | 4 | 5.1 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccc(F)c3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44593425 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1021/jm701249f | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1021/jm701249f | ||
11634198 | 186783 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493344 | 186783 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
44573111 | 187014 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494738 | 187014 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
44593425 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL460480 | 176191 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2009.02.043 | ||
11634198 | 186783 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmc.2012.09.013 | ||
CHEMBL493344 | 186783 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmc.2012.09.013 | ||
44293591 | 101125 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298700 | 101125 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
71449141 | 79088 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 483 | 7 | 2 | 6 | 6.5 | CC[C@H]1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(O)nc3cc(Cl)c([N+](=O)[O-])cc23)N1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL2113716 | 79088 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 483 | 7 | 2 | 6 | 6.5 | CC[C@H]1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(O)nc3cc(Cl)c([N+](=O)[O-])cc23)N1 | 10.1016/j.bmcl.2003.12.101 | ||
11525693 | 69487 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 471 | 8 | 2 | 7 | 5.6 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193749 | 69487 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 471 | 8 | 2 | 7 | 5.6 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143815 | 170974 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 651 | 8 | 1 | 8 | 5.8 | Cc1c(N2CCN(Cc3cccc4ccsc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4464440 | 170974 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 651 | 8 | 1 | 8 | 5.8 | Cc1c(N2CCN(Cc3cccc4ccsc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
70691931 | 73840 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1924 | 45 | 22 | 28 | -1.5 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2023088 | 73840 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1924 | 45 | 22 | 28 | -1.5 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44402335 | 71272 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 470 | 8 | 1 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)CC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196337 | 71272 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 470 | 8 | 1 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)CC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402273 | 139743 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 456 | 7 | 1 | 7 | 5.8 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL380576 | 139743 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 456 | 7 | 1 | 7 | 5.8 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391771 | 165469 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.7 | CC(C)(C)NC(=O)NCCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL425524 | 165469 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.7 | CC(C)(C)NC(=O)NCCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL405438 | 155184 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 1820 | 46 | 20 | 18 | 5.7 | C=CC1=C(C)c2cc1cc1[nH]c(cc3nc(cc4[nH]c(c2)c(C=C)c4C)C(C)=C3CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccc2)NC(=O)C2CCC(=O)N2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)C2CC[C@@H](C(=O)NCC(N)=O)N2)c(CCC(=O)O)c1C | 10.1021/jm020535y | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
162653870 | 179961 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 489 | 4 | 1 | 4 | 3.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(C)(=O)=O)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4753775 | 179961 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 489 | 4 | 1 | 4 | 3.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(C)(=O)=O)C2C | 10.1021/acs.jmedchem.0c01076 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
162652474 | 179869 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 519 | 5 | 1 | 3 | 5.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(Cc1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4752711 | 179869 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 519 | 5 | 1 | 3 | 5.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(Cc1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
87285770 | 175470 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 803 | 15 | 2 | 10 | 6.4 | CCOP(=O)(O)CCCN[C@@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4590493 | 175470 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 803 | 15 | 2 | 10 | 6.4 | CCOP(=O)(O)CCCN[C@@H](Cn1c(=O)c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/acs.jmedchem.6b01071 | ||
44444673 | 93847 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250389 | 93847 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44573790 | 192659 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 5 | 1 | 5 | 5.9 | Cc1c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)ncn1C(C)C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523849 | 192659 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 470 | 5 | 1 | 5 | 5.9 | Cc1c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)ncn1C(C)C | 10.1016/j.bmcl.2009.02.043 | ||
44402469 | 71334 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 599 | 13 | 3 | 9 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196439 | 71334 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 599 | 13 | 3 | 9 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
67142711 | 171457 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3ccccc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4471620 | 171457 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3ccccc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
145957680 | 161548 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 563 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3C(F)(F)F)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4161096 | 161548 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 563 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3C(F)(F)F)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44359200 | 12099 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 509 | 8 | 2 | 5 | 6.3 | CCN(CC)C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184288 | 12099 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 509 | 8 | 2 | 5 | 6.3 | CCN(CC)C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL343040 | 12099 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 509 | 8 | 2 | 5 | 6.3 | CCN(CC)C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
44388018 | 60152 | 0 | None | 389 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175443 | 60152 | 0 | None | 389 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44402649 | 97734 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 675 | 15 | 3 | 9 | 6.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL274002 | 97734 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 675 | 15 | 3 | 9 | 6.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
145948913 | 166925 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1276 | 29 | 16 | 15 | -1.9 | NC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H]2CCC(=O)N2)CCC1 | 10.1039/C5MD00259A | ||
CHEMBL4299455 | 166925 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1276 | 29 | 16 | 15 | -1.9 | NC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H]2CCC(=O)N2)CCC1 | 10.1039/C5MD00259A | ||
44365485 | 121013 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 9 | 3 | 3 | 6.2 | Oc1ccc(CCCCNCCc2c(-c3cccc4cnccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL358524 | 121013 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 9 | 3 | 3 | 6.2 | Oc1ccc(CCCCNCCc2c(-c3cccc4cnccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402426 | 132236 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 455 | 8 | 2 | 7 | 5.1 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370028 | 132236 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 455 | 8 | 2 | 7 | 5.1 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391849 | 122439 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 7 | 1 | 4 | 4.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(C1CC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL360743 | 122439 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 7 | 1 | 4 | 4.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(C1CC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44391670 | 64361 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.8 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL181864 | 64361 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.8 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.10.089 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143613 | 170459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cccnc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4456703 | 170459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cccnc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44185958 | 154459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401349 | 154459 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
10077523 | 122199 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL360429 | 122199 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44395463 | 126254 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 627 | 7 | 2 | 7 | 7.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL365366 | 126254 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 627 | 7 | 2 | 7 | 7.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCC[C@H](C(F)(F)F)N2C)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
44380512 | 57132 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 617 | 9 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165456 | 57132 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 617 | 9 | 4 | 4 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccc3[nH]c(O)nc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
11980076 | 206711 | 27 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm990433g | ||||
CHEMBL1007 | 206711 | 27 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm990433g | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44444632 | 93884 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 622 | 7 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250569 | 93884 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 622 | 7 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143374 | 171175 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cncc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4467261 | 171175 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 614 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3cncc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67144466 | 175207 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 596 | 8 | 1 | 8 | 3.9 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4583933 | 175207 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 596 | 8 | 1 | 8 | 3.9 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
10032223 | 12097 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184284 | 12097 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342822 | 12097 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
18914263 | 96453 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL265774 | 96453 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 630 | 15 | 3 | 4 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293264 | 100744 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 560 | 12 | 3 | 4 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295908 | 100744 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 560 | 12 | 3 | 4 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44214069 | 100848 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 575 | 14 | 3 | 5 | 6.1 | CCOC(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL296644 | 100848 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 575 | 14 | 3 | 5 | 6.1 | CCOC(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292838 | 101047 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298074 | 101047 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 574 | 13 | 3 | 4 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
21254068 | 101318 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL300045 | 101318 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 602 | 12 | 3 | 5 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293076 | 101351 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 600 | 12 | 3 | 4 | 6.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL300268 | 101351 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 600 | 12 | 3 | 4 | 6.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293070 | 165542 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL42592 | 165542 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 616 | 15 | 3 | 4 | 7.0 | CCN(CC)C(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
18914272 | 169114 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL443768 | 169114 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 14 | 3 | 4 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
21254089 | 181075 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47761 | 181075 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44413066 | 77996 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 579 | 10 | 1 | 7 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL211098 | 77996 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 579 | 10 | 1 | 7 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44412947 | 96313 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 608 | 10 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(N(C)C(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL264574 | 96313 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 608 | 10 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(N(C)C(=O)NC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
44348572 | 96852 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](NC(=O)CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL269097 | 96852 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](NC(=O)CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44348571 | 159473 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](NC(=O)CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL410799 | 159473 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1575 | 41 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@H](NC(=O)CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44292869 | 176448 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL46312 | 176448 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)c4cnccn4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44296258 | 101154 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCC(C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL298937 | 101154 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 613 | 7 | 3 | 7 | 7.1 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCCC(C(F)(F)F)N2)cc(C)c1C | 10.1016/j.bmcl.2003.12.101 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
44321100 | 106609 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC(CC5)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL315909 | 106609 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.5 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC(CC5)C4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
9961721 | 167914 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44380552 | 58451 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168655 | 58451 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44380317 | 167924 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL435262 | 167924 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2cncc3ccccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44293485 | 101045 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298051 | 101045 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 590 | 12 | 1 | 3 | 8.2 | CCN(CCCCc1ccncc1)CCc1c(-c2cc(C)cc(C)c2)[nH]c2ccc(C(C)(C)C(=O)N3C4CCC3CC4)cc12 | 10.1016/s0960-894x(01)00275-x | ||
44402518 | 157980 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL409138 | 157980 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
15602805 | 8023 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091579 | 8023 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
145962692 | 161706 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccco3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4163619 | 161706 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccco3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44359287 | 11530 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180743 | 11530 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139993 | 11530 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)on4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293348 | 100026 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL290991 | 100026 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293486 | 186834 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49374 | 186834 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 592 | 13 | 2 | 3 | 8.5 | CCN(C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44292939 | 100932 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL297269 | 100932 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 508 | 7 | 4 | 5 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)NC4CC4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44402395 | 168526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL439879 | 168526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
155569451 | 175634 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1711 | 48 | 21 | 25 | -3.8 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCNC(=O)CCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
CHEMBL4593899 | 175634 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1711 | 48 | 21 | 25 | -3.8 | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCNC(=O)CCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44380212 | 57313 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL166843 | 57313 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44348535 | 159878 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1561 | 39 | 14 | 17 | 2.0 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)CCNC(C)C)cc1 | 10.1021/jm970024p | ||
CHEMBL411144 | 159878 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1561 | 39 | 14 | 17 | 2.0 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)CCNC(C)C)cc1 | 10.1021/jm970024p | ||
CHEMBL407619 | 210924 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NCC(=O)n2cc(C)c(=O)[nH]c2=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44402395 | 168526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL439879 | 168526 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1649 | 43 | 18 | 19 | 1.4 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@@H](N)CC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL407619 | 210924 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NCC(=O)n2cc(C)c(=O)[nH]c2=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1016/j.bmcl.2005.03.085 | ||||
87285521 | 174447 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccnc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4567165 | 174447 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccnc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44321147 | 162928 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 618 | 11 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CCCC5)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL420051 | 162928 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 618 | 11 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCC5(CCCC5)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
53239615 | 175292 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 585 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3ccco3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4585969 | 175292 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 585 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3ccco3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44359458 | 12041 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184171 | 12041 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL336884 | 12041 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 545 | 7 | 3 | 7 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
10345138 | 122042 | 0 | None | 2041 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL360143 | 122042 | 0 | None | 2041 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL75347 | 122042 | 0 | None | 2041 | 2 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
44293335 | 172058 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL449351 | 172058 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 550 | 12 | 2 | 3 | 7.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1)C1CCCCC1 | 10.1016/s0960-894x(01)00275-x | ||
44293487 | 101163 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299006 | 101163 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 594 | 15 | 2 | 3 | 8.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293803 | 188295 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50721 | 188295 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 564 | 11 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44402398 | 96531 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1536 | 41 | 17 | 18 | 1.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL266420 | 96531 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1536 | 41 | 17 | 18 | 1.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
87285768 | 169927 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143420 | 162358 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4173938 | 162358 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44359471 | 12092 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184266 | 12092 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341717 | 12092 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 550 | 7 | 3 | 7 | 6.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)ns4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
162649425 | 179440 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 555 | 5 | 1 | 6 | 3.9 | O=C(Nc1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4747322 | 179440 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 555 | 5 | 1 | 6 | 3.9 | O=C(Nc1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
86275345 | 181488 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4781434 | 181488 | 1 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
10897903 | 79365 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 694 | 11 | 0 | 8 | 7.2 | CCC(=O)N(C)c1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21185 | 79365 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 694 | 11 | 0 | 8 | 7.2 | CCC(=O)N(C)c1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44274227 | 98436 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 654 | 10 | 0 | 9 | 6.8 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc([N+](=O)[O-])cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
CHEMBL279223 | 98436 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 654 | 10 | 0 | 9 | 6.8 | COc1cccc(-n2c(=O)c3c(CN(C)Cc4ccccc4)c(-c4ccc([N+](=O)[O-])cc4)sc3n(Cc3c(F)cccc3F)c2=O)c1 | 10.1021/jm020180i | ||
44274247 | 98935 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL282679 | 98935 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(OC)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
15895695 | 106471 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL314963 | 106471 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44365771 | 119079 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 10 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL346195 | 119079 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 10 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL96693 | 214142 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](C)C(=O)N[C@H](CCCCN)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44573628 | 192614 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 473 | 5 | 1 | 5 | 6.2 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523527 | 192614 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 473 | 5 | 1 | 5 | 6.2 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
67142907 | 169792 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 597 | 8 | 1 | 9 | 3.3 | Cc1c(N2CCN(Cc3cnccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4447551 | 169792 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 597 | 8 | 1 | 9 | 3.3 | Cc1c(N2CCN(Cc3cnccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44305306 | 100150 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 661 | 11 | 1 | 8 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccccc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL291893 | 100150 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 661 | 11 | 1 | 8 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccccc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
44391752 | 161113 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL413062 | 161113 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
145958486 | 161634 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 8 | 1 | 7 | 4.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccc(SC)cc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4162543 | 161634 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 541 | 8 | 1 | 7 | 4.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccc(SC)cc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44365459 | 98351 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 384 | 7 | 3 | 2 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL278496 | 98351 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 384 | 7 | 3 | 2 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44365399 | 119168 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL347121 | 119168 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44365457 | 168102 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 426 | 10 | 3 | 2 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL436414 | 168102 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 426 | 10 | 3 | 2 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44274228 | 98221 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccc(Cl)cc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL277436 | 98221 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccc(Cl)cc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44274229 | 98253 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(Cl)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL277653 | 98253 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2cccc(Cl)c2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44274475 | 98695 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2OC)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL281167 | 98695 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2OC)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322442 | 112258 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 424 | 5 | 1 | 4 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL330524 | 112258 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 424 | 5 | 1 | 4 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44322433 | 204944 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 5 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCC2CCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89443 | 204944 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 5 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCC2CCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
11692806 | 79406 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL212051 | 79406 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11606766 | 79440 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccccc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL212207 | 79440 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccccc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11512905 | 137890 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL377396 | 137890 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 628 | 10 | 2 | 6 | 7.3 | CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
44267059 | 8416 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 503 | 12 | 3 | 3 | 6.4 | CCS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL10941 | 8416 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 503 | 12 | 3 | 3 | 6.4 | CCS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
44267091 | 9708 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 453 | 10 | 3 | 2 | 6.6 | CC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11370 | 9708 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 453 | 10 | 3 | 2 | 6.6 | CC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
44267250 | 9080 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 8 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11021 | 9080 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 8 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44267233 | 9812 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11436 | 9812 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402589 | 124652 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 542 | 9 | 2 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364510 | 124652 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 542 | 9 | 2 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44391826 | 64551 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 549 | 10 | 3 | 6 | 4.2 | COc1ccc(CNS(=O)(=O)c2ccc3c(c2)nc(CCNC(=O)NC(C)(C)C)n3Cc2ccccc2)cc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL182178 | 64551 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 549 | 10 | 3 | 6 | 4.2 | COc1ccc(CNS(=O)(=O)c2ccc3c(c2)nc(CCNC(=O)NC(C)(C)C)n3Cc2ccccc2)cc1 | 10.1016/j.bmcl.2004.10.090 | ||
44391566 | 65280 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 455 | 8 | 1 | 5 | 4.8 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183376 | 65280 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 455 | 8 | 1 | 5 | 4.8 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
9961721 | 167914 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44365169 | 40206 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 458 | 12 | 3 | 4 | 6.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL148244 | 40206 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 458 | 12 | 3 | 4 | 6.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44365616 | 41132 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 444 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149004 | 41132 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 444 | 11 | 3 | 4 | 5.7 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44365617 | 42333 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 11 | 4 | 5 | 4.7 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@H](O)CCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL150041 | 42333 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 11 | 4 | 5 | 4.7 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@H](O)CCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
3823 | 49951 | 38 | None | -1 | 11 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
76973198 | 49951 | 38 | None | -1 | 11 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL157101 | 49951 | 38 | None | -1 | 11 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
90663999 | 106347 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 709 | 12 | 3 | 10 | 3.4 | O=C(NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1C(=O)OCc1ccccc1 | 10.1021/jm00129a003 | ||
CHEMBL3144570 | 106347 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 709 | 12 | 3 | 10 | 3.4 | O=C(NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1C(=O)OCc1ccccc1 | 10.1021/jm00129a003 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10624976 | 21413 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 4.7 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNC)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL131751 | 21413 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 4.7 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNC)c2c1=O | 10.1021/jm0512894 | ||
11592473 | 77680 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 568 | 11 | 1 | 8 | 6.3 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNCc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL209880 | 77680 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 568 | 11 | 1 | 8 | 6.3 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNCc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44348358 | 140947 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1529 | 40 | 15 | 19 | 0.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](NC(=O)c2cnccn2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL384385 | 140947 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1529 | 40 | 15 | 19 | 0.7 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](NC(=O)c2cnccn2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44391574 | 65759 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 4.2 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccsc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183847 | 65759 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 4.2 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccsc1 | 10.1016/j.bmcl.2004.10.089 | ||
10624976 | 21413 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 4.7 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNC)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL131751 | 21413 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 4.7 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CNC)c2c1=O | 10.1021/jm9803673 | ||
44365172 | 42453 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 402 | 8 | 3 | 4 | 4.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL150150 | 42453 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 402 | 8 | 3 | 4 | 4.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67142907 | 169792 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 597 | 8 | 1 | 9 | 3.3 | Cc1c(N2CCN(Cc3cnccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4447551 | 169792 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 597 | 8 | 1 | 9 | 3.3 | Cc1c(N2CCN(Cc3cnccn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
118179174 | 181894 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 6 | 1 | 4 | 4.6 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4786609 | 181894 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 6 | 1 | 4 | 4.6 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
12784 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
85469632 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
118179135 | 181436 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4780737 | 181436 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
12784 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
85469632 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
44321458 | 105485 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 658 | 11 | 2 | 3 | 9.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCCC5C5CCCCC54)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313004 | 105485 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 658 | 11 | 2 | 3 | 9.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCCCC5C5CCCCC54)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
11618517 | 186973 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]cn5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494554 | 186973 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]cn5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmcl.2009.02.043 | ||
44573670 | 187100 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 459 | 4 | 1 | 5 | 5.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)s1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495174 | 187100 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 459 | 4 | 1 | 5 | 5.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)s1 | 10.1016/j.bmcl.2009.02.043 | ||
11712618 | 179646 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL474992 | 179646 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6ncccc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44402403 | 71185 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 9 | 3 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)O)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196288 | 71185 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 9 | 3 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)O)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402649 | 97734 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 675 | 15 | 3 | 9 | 6.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL274002 | 97734 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 675 | 15 | 3 | 9 | 6.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44267255 | 97696 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 8 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL273725 | 97696 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 383 | 8 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402670 | 71614 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 11 | 4 | 9 | 4.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCN)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197317 | 71614 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 11 | 4 | 9 | 4.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCN)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402673 | 132747 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 499 | 10 | 2 | 7 | 6.4 | CCCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370414 | 132747 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 499 | 10 | 2 | 7 | 6.4 | CCCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44391516 | 64042 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 4.4 | CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL181301 | 64042 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 4.4 | CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402405 | 140786 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 395 | 7 | 1 | 5 | 5.3 | COc1ccccc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL383393 | 140786 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 395 | 7 | 1 | 5 | 5.3 | COc1ccccc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391613 | 167712 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 462 | 9 | 1 | 7 | 2.4 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1CCN1CCOCC1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL433954 | 167712 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 462 | 9 | 1 | 7 | 2.4 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1CCN1CCOCC1 | 10.1016/j.bmcl.2004.10.089 | ||
44593415 | 188790 | 0 | None | - | 1 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL512893 | 188790 | 0 | None | - | 1 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
67143509 | 169498 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4443108 | 169498 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143490 | 171043 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cscn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4465381 | 171043 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cscn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67144353 | 171657 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 673 | 9 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4474058 | 171657 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 673 | 9 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
87285495 | 171586 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 664 | 8 | 1 | 8 | 5.0 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)n3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4473194 | 171586 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 664 | 8 | 1 | 8 | 5.0 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)n3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44267258 | 96925 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccccn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL269636 | 96925 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 369 | 7 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCc2ccccn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL413854 | 161201 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1810 | 46 | 21 | 19 | 4.4 | C=CC1=C(C)c2cc1cc1[nH]c(cc3nc(cc4[nH]c(c2)c(C=C)c4C)C(C)=C3CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)C2CCC(=O)N2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)C2CC[C@@H](C(=O)NCC(N)=O)N2)c(CCC(=O)O)c1C | 10.1021/jm020535y | ||
91810333 | 178998 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 595 | 7 | 1 | 4 | 5.4 | C=CCC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCN(C(C)=O)CC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4741994 | 178998 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 595 | 7 | 1 | 4 | 5.4 | C=CCC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCN(C(C)=O)CC2 | 10.1021/acs.jmedchem.0c01076 | ||
11619461 | 187102 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495183 | 187102 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391808 | 65264 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 587 | 9 | 3 | 5 | 5.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3Cl)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183274 | 65264 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 587 | 9 | 3 | 5 | 5.5 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3Cl)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL2430897 | 208713 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCCCCCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.bmcl.2013.08.075 | ||||
56655880 | 73839 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1841 | 41 | 22 | 28 | -2.8 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2023087 | 73839 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 1841 | 41 | 22 | 28 | -2.8 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1016/j.ejmech.2012.08.014 | ||
25193700 | 172711 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452547 | 172711 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44348055 | 168443 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)c2ccncc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL439258 | 168443 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)c2ccncc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44267042 | 9314 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 12 | 3 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(=O)(=O)C(C)C)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11156 | 9314 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 12 | 3 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(=O)(=O)C(C)C)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
44391516 | 64042 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 4.4 | CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL181301 | 64042 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 441 | 7 | 1 | 5 | 4.4 | CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL409979 | 211045 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O | 10.1021/jm990433g | ||||
71623059 | 180243 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4756920 | 180243 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
155538326 | 171812 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 664 | 8 | 1 | 8 | 5.0 | Cc1c(N2CCN(Cc3ccnc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4476330 | 171812 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 664 | 8 | 1 | 8 | 5.0 | Cc1c(N2CCN(Cc3ccnc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
162656174 | 180292 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 589 | 5 | 2 | 5 | 5.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)(C(F)(F)F)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4757424 | 180292 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 589 | 5 | 2 | 5 | 5.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)(C(F)(F)F)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL2370263 | 208079 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm990433g | ||||
44573713 | 192287 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL522202 | 192287 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44359419 | 12105 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)no4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184330 | 12105 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)no4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL344688 | 12105 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 534 | 7 | 3 | 7 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)no4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293592 | 162340 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL417363 | 162340 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 12 | 2 | 3 | 6.5 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44402471 | 134698 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 485 | 9 | 2 | 7 | 6.0 | CCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL372316 | 134698 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 485 | 9 | 2 | 7 | 6.0 | CCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44402645 | 168558 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 528 | 9 | 3 | 8 | 4.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL440212 | 168558 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 528 | 9 | 3 | 8 | 4.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67143621 | 170737 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4460880 | 170737 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1cccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL265010 | 208889 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44346667 | 113244 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44391728 | 65344 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183430 | 65344 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44391784 | 121812 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.9 | CC(C)(C)NC(=O)CCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL359860 | 121812 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.9 | CC(C)(C)NC(=O)CCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
86274853 | 115687 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 662 | 6 | 1 | 7 | 4.5 | N#Cc1cccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ncc(C(F)(F)F)cc4F)cc3C3(CCS(=O)(=O)CC3)C2C2CC2)c1 | 10.1021/ml5004469 | ||
CHEMBL3358414 | 115687 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 662 | 6 | 1 | 7 | 4.5 | N#Cc1cccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ncc(C(F)(F)F)cc4F)cc3C3(CCS(=O)(=O)CC3)C2C2CC2)c1 | 10.1021/ml5004469 | ||
44215908 | 93794 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249982 | 93794 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
118178976 | 180599 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 595 | 6 | 1 | 4 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4761024 | 180599 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 595 | 6 | 1 | 4 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
12784 | 571 | 8 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
85469632 | 571 | 8 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
24825725 | 192027 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL521674 | 192027 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
24825725 | 192027 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL521674 | 192027 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
44572287 | 180221 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475660 | 180221 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 4 | 1 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6cccnc6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44293343 | 161663 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 545 | 12 | 4 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NCc4ccccc4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL416286 | 161663 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 545 | 12 | 4 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NCc4ccccc4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
67144582 | 175133 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1ccccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4582222 | 175133 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 653 | 9 | 1 | 9 | 4.3 | COC(=O)c1ccccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44402499 | 69480 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccncc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193689 | 69480 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccncc1 | 10.1016/j.bmcl.2005.03.030 | ||
44391714 | 121621 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccncc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL359668 | 121621 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccncc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL4564312 | 212259 | 2 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)[C@@H](C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | nan | ||||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
10208964 | 66349 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 7 | 2 | 7 | 7.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCC2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
CHEMBL185438 | 66349 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 7 | 2 | 7 | 7.2 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnsn4)cc3c2OCCC2CCCC2)cc(C)c1C | 10.1016/j.bmcl.2004.08.056 | ||
86275345 | 181488 | 1 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4781434 | 181488 | 1 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44444617 | 93711 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249372 | 93711 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 656 | 8 | 2 | 5 | 7.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N(C)C)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
71666685 | 182132 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 569 | 6 | 1 | 6 | 3.6 | O=C(NCc1ccccn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4789613 | 182132 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 569 | 6 | 1 | 6 | 3.6 | O=C(NCc1ccccn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
86275343 | 182909 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 655 | 6 | 1 | 6 | 4.7 | O=C(NCc1ncc(C(F)(F)F)cc1F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4799511 | 182909 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 655 | 6 | 1 | 6 | 4.7 | O=C(NCc1ncc(C(F)(F)F)cc1F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44322432 | 204955 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 427 | 6 | 2 | 6 | 4.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL89501 | 204955 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 427 | 6 | 2 | 6 | 4.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2CCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44365628 | 38697 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 10 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(C)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL146762 | 38697 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 10 | 3 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(C)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL264501 | 208877 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44365458 | 41628 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 8 | 3 | 2 | 5.9 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149387 | 41628 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 8 | 3 | 2 | 5.9 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
87285565 | 169702 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 679 | 9 | 1 | 8 | 5.4 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446131 | 169702 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 679 | 9 | 1 | 8 | 5.4 | Cc1c(N2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11619461 | 187102 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495183 | 187102 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
44402072 | 71395 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 442 | 8 | 1 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196616 | 71395 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 442 | 8 | 1 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391566 | 65280 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 8 | 1 | 5 | 4.8 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183376 | 65280 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 8 | 1 | 5 | 4.8 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365251 | 38338 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 440 | 9 | 3 | 3 | 6.9 | Oc1ccc(CCCCNCCc2c(-c3cc4ccccc4s3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL146484 | 38338 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 440 | 9 | 3 | 3 | 6.9 | Oc1ccc(CCCCNCCc2c(-c3cc4ccccc4s3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
44214066 | 167772 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 434 | 9 | 3 | 2 | 6.8 | Oc1ccc(CCCCNCCc2c(-c3ccc4ccccc4c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL434318 | 167772 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 434 | 9 | 3 | 2 | 6.8 | Oc1ccc(CCCCNCCc2c(-c3ccc4ccccc4c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
44348357 | 96147 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1532 | 40 | 17 | 19 | 0.2 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)c2c[nH]nc2N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
77068809 | 96147 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1532 | 40 | 17 | 19 | 0.2 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)c2c[nH]nc2N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL263200 | 96147 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1532 | 40 | 17 | 19 | 0.2 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](NC(=O)c2c[nH]nc2N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
162670223 | 181989 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 5 | 2 | 5 | 4.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4787856 | 181989 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 5 | 2 | 5 | 4.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
162650892 | 179649 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749974 | 179649 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44573112 | 187015 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.9 | CCCCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494739 | 187015 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.9 | CCCCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
11583756 | 189062 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL515123 | 189062 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6nccnc56)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL2430898 | 208714 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.bmcl.2013.08.075 | ||||
67143119 | 175281 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 742 | 14 | 2 | 11 | 4.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCCCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4585638 | 175281 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 742 | 14 | 2 | 11 | 4.7 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCCCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44402470 | 140600 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 437 | 8 | 1 | 6 | 5.5 | COc1ccc(C(C)=O)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL382747 | 140600 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 437 | 8 | 1 | 6 | 5.5 | COc1ccc(C(C)=O)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391835 | 165751 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.8 | CC(C)(C)CC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL427146 | 165751 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.8 | CC(C)(C)CC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
87285554 | 172758 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4526641 | 172758 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 631 | 8 | 1 | 7 | 4.8 | Cc1c(N2CCN(Cc3cccc(F)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
118178983 | 182849 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 552 | 5 | 1 | 5 | 4.1 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1cccnc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4798682 | 182849 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 552 | 5 | 1 | 5 | 4.1 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1cccnc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
12784 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
85469632 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | nan | ||
118167818 | 178852 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740373 | 178852 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
44365919 | 120545 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 597 | 12 | 4 | 6 | 4.9 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(CC(N)=O)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL356890 | 120545 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 597 | 12 | 4 | 6 | 4.9 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(CC(N)=O)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
44573626 | 186949 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494416 | 186949 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)o1 | 10.1016/j.bmcl.2009.02.043 | ||
44573627 | 192260 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 459 | 4 | 1 | 5 | 5.9 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL522188 | 192260 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 459 | 4 | 1 | 5 | 5.9 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)s1 | 10.1016/j.bmcl.2009.02.043 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44444628 | 93883 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250568 | 93883 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
12784 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
85469632 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
9979079 | 8279 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
9979079 | 8279 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402472 | 132300 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370145 | 132300 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44380192 | 57146 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL165534 | 57146 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 584 | 8 | 2 | 3 | 8.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCc2cccc3ncccc23)c1 | 10.1016/s0960-894x(02)00026-4 | ||
118074127 | 175144 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 714 | 12 | 2 | 11 | 3.9 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4582367 | 175144 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 714 | 12 | 2 | 11 | 3.9 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2OCC(=O)O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
87285473 | 173518 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 663 | 8 | 1 | 7 | 5.6 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4544693 | 173518 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 663 | 8 | 1 | 7 | 5.6 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44267251 | 98026 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 9 | 2 | 3 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cncnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL275920 | 98026 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 9 | 2 | 3 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cncnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402589 | 124652 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 542 | 9 | 2 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364510 | 124652 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 542 | 9 | 2 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44391612 | 63168 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 9 | 2 | 6 | 3.8 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCO)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL179977 | 63168 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 9 | 2 | 6 | 3.8 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCO)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44444663 | 93766 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249771 | 93766 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
87285768 | 169927 | 1 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
118179051 | 179638 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL385022 | 210594 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](C)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
CHEMBL405176 | 210800 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
11604354 | 186941 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494400 | 186941 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44359331 | 12035 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nnc(C)s4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184148 | 12035 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nnc(C)s4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL334904 | 12035 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 551 | 7 | 3 | 8 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nnc(C)s4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44267036 | 9588 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 482 | 11 | 4 | 2 | 6.7 | CCNC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11299 | 9588 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 482 | 11 | 4 | 2 | 6.7 | CCNC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
44402256 | 135756 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 519 | 8 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL373340 | 135756 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 519 | 8 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
67143633 | 172738 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 612 | 8 | 2 | 8 | 3.2 | Cc1c(N2CCN(Cc3ccc(=O)[nH]c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4526188 | 172738 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 612 | 8 | 2 | 8 | 3.2 | Cc1c(N2CCN(Cc3ccc(=O)[nH]c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL93608 | 214129 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc2ccccc2c1)C(N)=O | 10.1021/jm990433g | ||||
44348298 | 81138 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(Cl)cc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL216112 | 81138 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2ccc(Cl)cc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44402431 | 71069 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 440 | 8 | 1 | 7 | 5.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195924 | 71069 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 440 | 8 | 1 | 7 | 5.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402378 | 69333 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 457 | 8 | 2 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193529 | 69333 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 457 | 8 | 2 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402553 | 71089 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 529 | 9 | 2 | 9 | 5.4 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)OC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196079 | 71089 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 529 | 9 | 2 | 9 | 5.4 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)OC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402057 | 71594 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.8 | COCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197254 | 71594 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.8 | COCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44391548 | 65702 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 8 | 1 | 5 | 5.3 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183698 | 65702 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 471 | 8 | 1 | 5 | 5.3 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44391728 | 65344 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183430 | 65344 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 10 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365250 | 121344 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 437 | 9 | 3 | 3 | 6.2 | Cn1ccc2cc(-c3[nH]c4ccccc4c3CCNCCCCc3ccc(O)cc3)ccc21 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL359001 | 121344 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 437 | 9 | 3 | 3 | 6.2 | Cn1ccc2cc(-c3[nH]c4ccccc4c3CCNCCCCc3ccc(O)cc3)ccc21 | 10.1016/s0960-894x(00)00707-1 | ||
145948856 | 166921 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1290 | 29 | 16 | 15 | -1.5 | NC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H]2CCC(=O)N2)CCCC1 | 10.1039/C5MD00259A | ||
CHEMBL4299432 | 166921 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1290 | 29 | 16 | 15 | -1.5 | NC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H]2CCC(=O)N2)CCCC1 | 10.1039/C5MD00259A | ||
118179051 | 179638 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573277 | 186863 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493931 | 186863 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
15602808 | 8025 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091580 | 8025 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67144466 | 175207 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 596 | 8 | 1 | 8 | 3.9 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4583933 | 175207 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 596 | 8 | 1 | 8 | 3.9 | Cc1c(N2CCN(Cc3cccnc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11618517 | 186973 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]cn5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494554 | 186973 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 4.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]cn5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmcl.2009.02.043 | ||
11583388 | 8206 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 457 | 5 | 2 | 5 | 4.8 | CCc1nc(CN2CCN(c3cncc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092626 | 8206 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 457 | 5 | 2 | 5 | 4.8 | CCc1nc(CN2CCN(c3cncc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44359312 | 12095 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184274 | 12095 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL342396 | 12095 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44305286 | 100281 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 611 | 11 | 1 | 8 | 5.4 | C=CC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL292773 | 100281 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 611 | 11 | 1 | 8 | 5.4 | C=CC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00372-4 | ||
44305362 | 102211 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 651 | 11 | 1 | 9 | 6.1 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccoc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL304633 | 102211 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 651 | 11 | 1 | 9 | 6.1 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccoc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
44380551 | 58450 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL168649 | 58450 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 612 | 10 | 2 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCc2ccc3ncccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
44293075 | 90233 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL239108 | 90233 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 614 | 12 | 3 | 4 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44214108 | 100647 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295152 | 100647 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 656 | 13 | 3 | 4 | 7.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293053 | 101022 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297918 | 101022 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 13 | 3 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293054 | 101025 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297927 | 101025 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 603 | 14 | 3 | 5 | 6.8 | CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292977 | 173665 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45489 | 173665 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 616 | 14 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C(C)C)C(C)C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292785 | 176433 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 499 | 10 | 3 | 4 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL46268 | 176433 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 499 | 10 | 3 | 4 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293194 | 185853 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 14 | 3 | 4 | 6.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL48763 | 185853 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 14 | 3 | 4 | 6.8 | CCN(C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1)C(C)C | 10.1016/s0960-894x(01)00274-8 | ||
18914248 | 187148 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49542 | 187148 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 602 | 15 | 3 | 4 | 6.4 | CCN(CC)C(=O)Cc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293074 | 187200 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49578 | 187200 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 612 | 12 | 3 | 4 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292827 | 187605 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49891 | 187605 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 628 | 13 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(CC(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44348401 | 161150 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](NC(C)=O)NC(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL413456 | 161150 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1561 | 40 | 15 | 17 | 2.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](NC(C)=O)NC(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67142985 | 172309 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3cccc(Cl)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4515452 | 172309 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 4.3 | Cc1c(N2CCN(Cc3cccc(Cl)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44293484 | 96268 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 604 | 12 | 1 | 3 | 8.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)C(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL264193 | 96268 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 604 | 12 | 1 | 3 | 8.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)C(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
44402398 | 96531 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1536 | 41 | 17 | 18 | 1.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL266420 | 96531 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1536 | 41 | 17 | 18 | 1.6 | CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(NC(N)=O)cc1)NC(=O)[C@H](Cc1ccc(NC(=O)C(N)CN)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
44402638 | 160711 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1592 | 43 | 17 | 18 | 2.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CCN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL411987 | 160711 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1592 | 43 | 17 | 18 | 2.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CCN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
10258659 | 12093 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184268 | 12093 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL341809 | 12093 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
22100905 | 183684 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL48380 | 183684 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
86275342 | 115686 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/ml5004469 | ||
CHEMBL3358413 | 115686 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/ml5004469 | ||
44341081 | 167501 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 590 | 10 | 2 | 3 | 8.0 | CCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL432450 | 167501 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 590 | 10 | 2 | 3 | 8.0 | CCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44293511 | 100816 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296426 | 100816 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 538 | 13 | 2 | 3 | 7.1 | CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44572235 | 188917 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
CHEMBL513998 | 188917 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 522 | 4 | 2 | 6 | 4.4 | Cn1c(=O)c(=O)[nH]c2ccc(CN3CCN(c4cccc5[nH]c(-c6ccc(C(C)(C)C)cc6)nc45)CC3)cc21 | 10.1021/jm801572m | ||
44402638 | 160711 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1592 | 43 | 17 | 18 | 2.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CCN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL411987 | 160711 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1592 | 43 | 17 | 18 | 2.2 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CCN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44359333 | 11525 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180707 | 11525 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138999 | 11525 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293617 | 188090 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50380 | 188090 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 522 | 10 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C(C)CCC4C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44380148 | 119805 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
CHEMBL352782 | 119805 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 626 | 11 | 2 | 3 | 9.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNCCCCc2ccc3cnccc3c2)c1 | 10.1016/s0960-894x(02)00026-4 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
87285732 | 172383 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3ccc(Cl)nc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4517137 | 172383 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3ccc(Cl)nc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143598 | 170074 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4451280 | 170074 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44359191 | 12100 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184298 | 12100 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL343396 | 12100 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ccncc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44293284 | 183503 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 543 | 7 | 3 | 8 | 5.9 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc(Cl)s3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL48249 | 183503 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 543 | 7 | 3 | 8 | 5.9 | O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3ccc(Cl)s3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00318-8 | ||
11478448 | 65745 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 553 | 9 | 3 | 5 | 4.9 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183779 | 65745 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 553 | 9 | 3 | 5 | 4.9 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
15462663 | 98590 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccc(OC)cc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL280350 | 98590 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 639 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccc(OC)cc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44365612 | 40583 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 610 | 12 | 3 | 5 | 6.8 | CCCC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL148571 | 40583 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 610 | 12 | 3 | 5 | 6.8 | CCCC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
44365627 | 41399 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 582 | 10 | 3 | 5 | 6.0 | CC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149188 | 41399 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 582 | 10 | 3 | 5 | 6.0 | CC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
44365595 | 42285 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 485 | 10 | 4 | 4 | 6.0 | CNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149992 | 42285 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 485 | 10 | 4 | 4 | 6.0 | CNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
44292785 | 176433 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 10 | 3 | 4 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL46268 | 176433 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 10 | 3 | 4 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
44365865 | 193127 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 12 | 4 | 4 | 6.8 | CCCNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL538660 | 193127 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 12 | 4 | 4 | 6.8 | CCCNC(=O)Oc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
44444670 | 94043 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251388 | 94043 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 630 | 7 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCCC(O)C3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444678 | 154400 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401081 | 154400 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
9917213 | 201717 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 627 | 11 | 1 | 8 | 5.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL65569 | 201717 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 627 | 11 | 1 | 8 | 5.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
11642933 | 77756 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210277 | 77756 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44412946 | 77761 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 656 | 11 | 2 | 7 | 8.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)Nc4ccccc4)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210295 | 77761 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 656 | 11 | 2 | 7 | 8.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(NC(=O)Nc4ccccc4)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
70697569 | 77620 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.6 | CC(C)(C)CNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL2096778 | 77620 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.6 | CC(C)(C)CNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44365252 | 37566 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 9 | 3 | 3 | 6.9 | Oc1ccc(CCCCNCCc2c(-c3csc4ccccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL145840 | 37566 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 9 | 3 | 3 | 6.9 | Oc1ccc(CCCCNCCc2c(-c3csc4ccccc34)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
44322402 | 204480 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 5.6 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL86490 | 204480 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 5.6 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44322443 | 204768 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OC2CCCN(C)CC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL88293 | 204768 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 410 | 3 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OC2CCCN(C)CC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
9873394 | 79509 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 596 | 12 | 0 | 8 | 7.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(CC)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL212472 | 79509 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 596 | 12 | 0 | 8 | 7.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(CC)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11635837 | 138558 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccc(OC)cc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL378654 | 138558 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccc(OC)cc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11527301 | 138699 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2cccc(F)c2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL378845 | 138699 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2cccc(F)c2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44267057 | 8257 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 411 | 9 | 3 | 2 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL10929 | 8257 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 411 | 9 | 3 | 2 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
44267073 | 9145 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 414 | 9 | 2 | 1 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(F)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11067 | 9145 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 414 | 9 | 2 | 1 | 6.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(F)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
44267029 | 9157 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 12 | 3 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11074 | 9157 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 12 | 3 | 3 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
44402105 | 124283 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 533 | 9 | 2 | 7 | 6.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1CCc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364246 | 124283 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 533 | 9 | 2 | 7 | 6.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1CCc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
44391499 | 65602 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 439 | 8 | 1 | 5 | 4.1 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183600 | 65602 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 439 | 8 | 1 | 5 | 4.1 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365598 | 41402 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 11 | 4 | 6 | 4.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@@H](O)COc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149189 | 41402 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 11 | 4 | 6 | 4.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@@H](O)COc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44365351 | 121489 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 11 | 4 | 6 | 4.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@H](O)COc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL359370 | 121489 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 11 | 4 | 6 | 4.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC[C@H](O)COc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44365028 | 42224 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 457 | 10 | 3 | 4 | 5.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC(=O)CCCc2ccc(N)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149940 | 42224 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 457 | 10 | 3 | 4 | 5.1 | COc1ccc(-c2[nH]c3ccccc3c2CCNC(=O)CCCc2ccc(N)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44214065 | 120554 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 534 | 14 | 2 | 4 | 7.6 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(OCc3ccccc3)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL356970 | 120554 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 534 | 14 | 2 | 4 | 7.6 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(OCc3ccccc3)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
162667361 | 181943 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4787218 | 181943 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
162675445 | 182826 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4798298 | 182826 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL428186 | 211677 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N(C)CC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44573586 | 186918 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 443 | 4 | 1 | 5 | 5.5 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494232 | 186918 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 443 | 4 | 1 | 5 | 5.5 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402466 | 71541 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197089 | 71541 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44573713 | 192287 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL522202 | 192287 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)n(C)n1 | 10.1016/j.bmcl.2009.02.043 | ||
44391754 | 168108 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 9 | 3 | 5 | 4.2 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL436472 | 168108 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 9 | 3 | 5 | 4.2 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
162650892 | 179649 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749974 | 179649 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
9982147 | 204566 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL87020 | 204566 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44365644 | 41390 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 612 | 11 | 3 | 6 | 6.6 | CCOC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149181 | 41390 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 612 | 11 | 3 | 6 | 6.6 | CCOC(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
44365772 | 42142 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 539 | 10 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149881 | 42142 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 539 | 10 | 3 | 4 | 7.3 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCCCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
44561397 | 189232 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL516479 | 189232 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44359301 | 11531 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180754 | 11531 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141221 | 11531 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 537 | 7 | 3 | 8 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nncs4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44358957 | 12038 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184158 | 12038 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL336039 | 12038 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 530 | 7 | 3 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cccnc4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44293130 | 181310 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 482 | 11 | 3 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(N)=O)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL47791 | 181310 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 482 | 11 | 3 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(N)=O)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293131 | 188252 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 10 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL50663 | 188252 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 10 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4C5CCC4CC5)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44214072 | 176844 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 484 | 11 | 3 | 4 | 6.5 | CCOC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL46385 | 176844 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 484 | 11 | 3 | 4 | 6.5 | CCOC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
9982147 | 204566 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL87020 | 204566 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44573625 | 186948 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494415 | 186948 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
44359303 | 11532 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180760 | 11532 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL141539 | 11532 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 7 | 4 | 7 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4nc[nH]n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44391714 | 121621 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccncc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL359668 | 121621 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccncc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44402571 | 124433 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 5.6 | Cc1ccccc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364297 | 124433 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 5.6 | Cc1ccccc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391498 | 165567 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 524 | 10 | 1 | 7 | 3.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(OCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL426060 | 165567 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 524 | 10 | 1 | 7 | 3.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(OCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
67144370 | 174043 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4557575 | 174043 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3cccc(F)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143547 | 170950 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4464132 | 170950 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccc(C#N)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11626096 | 186687 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 4 | 1 | 5 | 4.6 | Cn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492780 | 186687 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 4 | 1 | 5 | 4.6 | Cn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1 | 10.1016/j.bmcl.2009.02.043 | ||
44444678 | 154400 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401081 | 154400 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 12 | 1 | 5 | 7.3 | CCN(CC)CCOC1CCN(CCc2c(-c3cc(C)cc(C)c3)[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc23)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
11620431 | 178789 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL473807 | 178789 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 509 | 4 | 3 | 6 | 3.8 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cnc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
11671279 | 130362 | 0 | None | 331 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL368511 | 130362 | 0 | None | 331 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44402492 | 125663 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1cccnc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364933 | 125663 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1cccnc1 | 10.1016/j.bmcl.2005.03.030 | ||
44402471 | 134698 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 485 | 9 | 2 | 7 | 6.0 | CCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL372316 | 134698 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 485 | 9 | 2 | 7 | 6.0 | CCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44391548 | 65702 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 1 | 5 | 5.3 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183698 | 65702 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 1 | 5 | 5.3 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44561105 | 186169 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 476 | 6 | 3 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL488812 | 186169 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 476 | 6 | 3 | 5 | 4.7 | FC(F)(F)c1nc2c(N3CCN(CCCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402572 | 70850 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 7 | 2 | 7 | 4.6 | CNC(=O)Nc1ccc2c(c1)nc(SCc1cc([N+](=O)[O-])ccc1OC)n2C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195626 | 70850 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 7 | 2 | 7 | 4.6 | CNC(=O)Nc1ccc2c(c1)nc(SCc1cc([N+](=O)[O-])ccc1OC)n2C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44444647 | 154462 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401352 | 154462 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 688 | 10 | 2 | 7 | 4.6 | CC(=O)N1CCN(CC(O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
44444676 | 154399 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401080 | 154399 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 646 | 9 | 1 | 6 | 5.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(OCC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
118179235 | 181353 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 548 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4779806 | 181353 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 548 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
118179051 | 179638 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573110 | 186611 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492327 | 186611 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
44577104 | 178169 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL468565 | 178169 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
11294792 | 62958 | 0 | None | 380 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL179269 | 62958 | 0 | None | 380 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
67143679 | 173589 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 4.8 | Cc1c(N2CCC(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4546864 | 173589 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 4.8 | Cc1c(N2CCC(Cc3ccccc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
67143755 | 174853 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4576169 | 174853 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44391826 | 64551 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 549 | 10 | 3 | 6 | 4.2 | COc1ccc(CNS(=O)(=O)c2ccc3c(c2)nc(CCNC(=O)NC(C)(C)C)n3Cc2ccccc2)cc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL182178 | 64551 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 549 | 10 | 3 | 6 | 4.2 | COc1ccc(CNS(=O)(=O)c2ccc3c(c2)nc(CCNC(=O)NC(C)(C)C)n3Cc2ccccc2)cc1 | 10.1016/j.bmcl.2004.10.090 | ||
44444645 | 154461 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401351 | 154461 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 672 | 9 | 2 | 6 | 4.8 | CC(=O)NC1CCN(C(=O)CN2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
162665107 | 181554 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ncccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4782228 | 181554 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ncccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
44444626 | 154344 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400739 | 154344 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
44402464 | 168523 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL439860 | 168523 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143749 | 169579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 561 | 8 | 2 | 8 | 3.4 | Cc1c(N2CCN(Cc3ccc(O)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4444237 | 169579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 561 | 8 | 2 | 8 | 3.4 | Cc1c(N2CCN(Cc3ccc(O)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
67143490 | 171043 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cscn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4465381 | 171043 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cscn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
11525358 | 186759 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493185 | 186759 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402360 | 132922 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 505 | 7 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1-c1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370623 | 132922 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 505 | 7 | 2 | 7 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1-c1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
67143710 | 169768 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4447139 | 169768 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 620 | 8 | 1 | 8 | 4.4 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
9979079 | 8279 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
9979079 | 8279 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
162660654 | 180718 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 4.2 | O=C(Nc1ccc2c(c1)C1(CC[S+]([O-])CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4762368 | 180718 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 4.2 | O=C(Nc1ccc2c(c1)C1(CC[S+]([O-])CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
44322400 | 204560 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL86976 | 204560 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCCCCN2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44322420 | 204968 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC2CCCNC2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL89672 | 204968 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC2CCCNC2)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44293274 | 100786 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL296199 | 100786 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 510 | 12 | 1 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(C)CCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293594 | 101096 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL298497 | 101096 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 512 | 13 | 3 | 4 | 5.5 | CCN(CCO)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccncc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44293134 | 186818 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL49366 | 186818 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 604 | 12 | 2 | 3 | 7.6 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44348278 | 156337 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2cccnc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL407193 | 156337 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C(=O)c2cccnc2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44267048 | 162669 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 10 | 3 | 3 | 5.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(S(N)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL418339 | 162669 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 10 | 3 | 3 | 5.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(S(N)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
44267256 | 9074 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 447 | 9 | 2 | 2 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cnc3ccccc3c2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11014 | 9074 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 447 | 9 | 2 | 2 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cnc3ccccc3c2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL2430900 | 208716 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCNC(=O)CCCCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.bmcl.2013.08.075 | ||||
67143674 | 174497 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4568223 | 174497 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44402105 | 124283 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 533 | 9 | 2 | 7 | 6.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1CCc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL364246 | 124283 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 533 | 9 | 2 | 7 | 6.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1CCc1ccccc1 | 10.1016/j.bmcl.2005.03.030 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
162645007 | 178881 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573625 | 186948 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494415 | 186948 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
15602806 | 8212 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092638 | 8212 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44402553 | 71089 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 529 | 9 | 2 | 9 | 5.4 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)OC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196079 | 71089 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 529 | 9 | 2 | 9 | 5.4 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)OC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL330173 | 209584 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44444668 | 153745 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL398648 | 153745 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 630 | 7 | 1 | 6 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(=O)CN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143804 | 172625 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 724 | 13 | 3 | 9 | 4.1 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4522657 | 172625 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 724 | 13 | 3 | 9 | 4.1 | Cc1c(N2CCN(Cc3cccc(C(=O)NCCCC(=O)O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
118179169 | 179346 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.4 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccc(F)cc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4746174 | 179346 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.4 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccc(F)cc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44328354 | 96707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 980 | 24 | 9 | 10 | 0.4 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
CHEMBL267986 | 96707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 980 | 24 | 9 | 10 | 0.4 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NCCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||
11518185 | 187105 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 4 | 1 | 5 | 5.2 | Cc1nn(C)c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495190 | 187105 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 4 | 1 | 5 | 5.2 | Cc1nn(C)c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391734 | 122103 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 509 | 10 | 3 | 5 | 3.6 | CCNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL360297 | 122103 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 509 | 10 | 3 | 5 | 3.6 | CCNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391692 | 63969 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 437 | 7 | 1 | 4 | 4.8 | CC(C)c1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL181057 | 63969 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 437 | 7 | 1 | 4 | 4.8 | CC(C)c1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
25194091 | 188423 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL508898 | 188423 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 498 | 7 | 3 | 5 | 5.5 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44322502 | 205247 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 390 | 4 | 1 | 4 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(C)ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL91311 | 205247 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 390 | 4 | 1 | 4 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(C)ccc3c2OCC2CCCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44309572 | 202636 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71561 | 202636 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 7 | 5.4 | Cc1cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4ncccn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(02)00370-0 | ||
44352512 | 116796 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 483 | 7 | 3 | 7 | 4.7 | Cc1cc(-c2c(O)nc3ccc(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL339636 | 116796 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 483 | 7 | 3 | 7 | 4.7 | Cc1cc(-c2c(O)nc3ccc(C(=O)Nc4ccncn4)cc3c2OCC[C@@H]2CCN2)cc(C)c1C | 10.1016/s0960-894x(01)00779-x | ||
10484172 | 98584 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 632 | 12 | 3 | 6 | 5.8 | CCS(=O)(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL280296 | 98584 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 632 | 12 | 3 | 6 | 5.8 | CCS(=O)(=O)N1CCN(C(=O)Oc2ccc3[nH]c(-c4cc(C)cc(C)c4)c(CCNCCCCc4ccc(O)cc4)c3c2)CC1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
10649568 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
10649568 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm049218c | ||
CHEMBL120432 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm049218c | ||
9936667 | 100052 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 525 | 10 | 3 | 4 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL291201 | 100052 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 525 | 10 | 3 | 4 | 5.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCOCC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293071 | 101130 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL298748 | 101130 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 589 | 14 | 3 | 5 | 6.6 | CCOC(=O)C(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293208 | 170577 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL445848 | 170577 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292988 | 181859 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47862 | 181859 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 586 | 12 | 3 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N4CCCC4)cc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
10603202 | 168037 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 573 | 9 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL435974 | 168037 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 573 | 9 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67142818 | 173475 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4543788 | 173475 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3ccccc3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
11478448 | 65745 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 553 | 9 | 3 | 5 | 4.9 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183779 | 65745 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 553 | 9 | 3 | 5 | 4.9 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
15602804 | 7998 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091209 | 7998 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44321496 | 105483 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 13 | 2 | 5 | 6.3 | CCS(=O)(=O)N1CCN(C(=O)C(C)(C)c2ccc3[nH]c(-c4cc(C)cc(C)c4)c([C@H](C)CNCCCCc4ccncc4)c3c2)CC1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL312995 | 105483 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 657 | 13 | 2 | 5 | 6.3 | CCS(=O)(=O)N1CCN(C(=O)C(C)(C)c2ccc3[nH]c(-c4cc(C)cc(C)c4)c([C@H](C)CNCCCCc4ccncc4)c3c2)CC1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44341080 | 110089 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.4 | CCCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL325417 | 110089 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 604 | 11 | 2 | 3 | 8.4 | CCCc1cc(CCNC[C@@H](C)c2c(-c3cc(C)cc(C)c3)[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc23)ccn1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44321291 | 204554 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 632 | 11 | 2 | 3 | 9.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5(C)CC4CC(C)(C)C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL86950 | 204554 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 632 | 11 | 2 | 3 | 9.3 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5(C)CC4CC(C)(C)C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
44321292 | 204563 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCCC4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL87000 | 204563 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 11 | 2 | 3 | 8.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCCC4C5)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44293804 | 101329 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300095 | 101329 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44593424 | 175559 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459215 | 175559 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44593424 | 175559 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL459215 | 175559 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
71623059 | 180243 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4756920 | 180243 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44365898 | 119151 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 442 | 10 | 3 | 3 | 6.3 | COc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL346903 | 119151 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 442 | 10 | 3 | 3 | 6.3 | COc1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(00)00708-3 | ||
44593424 | 175559 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459215 | 175559 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44593424 | 175559 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL459215 | 175559 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)[nH]c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44358962 | 12037 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184155 | 12037 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL335764 | 12037 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 559 | 7 | 3 | 7 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cc(C)nc(C)n4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
44267238 | 96072 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL262715 | 96072 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44413009 | 79355 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 537 | 9 | 1 | 7 | 6.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL211808 | 79355 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 537 | 9 | 1 | 7 | 6.2 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44266961 | 9069 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 13 | 4 | 3 | 5.9 | CCNS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11011 | 9069 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 13 | 4 | 3 | 5.9 | CCNS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
44267238 | 96072 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL262715 | 96072 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44365269 | 39628 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1ccc(C)c(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL147740 | 39628 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1ccc(C)c(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44274327 | 81771 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 589 | 10 | 0 | 7 | 6.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(CC(C)C)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21704 | 81771 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 589 | 10 | 0 | 7 | 6.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(CC(C)C)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
15462660 | 82414 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 623 | 10 | 0 | 7 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(Cc2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21804 | 82414 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 623 | 10 | 0 | 7 | 6.9 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(Cc2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
11527384 | 77137 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2cccc(OC)c2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL208714 | 77137 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2cccc(OC)c2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11226884 | 77315 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2ccc(F)cc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL208904 | 77315 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 10 | 0 | 7 | 6.7 | CCOC(=O)c1cn(Cc2ccc(F)cc2)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
71459964 | 79087 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 573 | 10 | 2 | 5 | 7.7 | Cc1cc(C)cc(-c2c(OCC[C@@H]3CCC[C@H](CCCc4ccccc4)N3)c3cc([N+](=O)[O-])c(Cl)cc3[nH]c2=O)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL2113713 | 79087 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 573 | 10 | 2 | 5 | 7.7 | Cc1cc(C)cc(-c2c(OCC[C@@H]3CCC[C@H](CCCc4ccccc4)N3)c3cc([N+](=O)[O-])c(Cl)cc3[nH]c2=O)c1 | 10.1016/j.bmcl.2003.12.101 | ||
44391784 | 121812 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.9 | CC(C)(C)NC(=O)CCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL359860 | 121812 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.9 | CC(C)(C)NC(=O)CCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44365171 | 38594 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 416 | 9 | 3 | 4 | 4.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL146678 | 38594 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 416 | 9 | 3 | 4 | 4.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322380 | 204801 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 382 | 4 | 1 | 4 | 5.0 | CN1CCCC(COc2c(-c3ccccc3)c(O)nc3cc(Cl)ccc23)C1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL88516 | 204801 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 382 | 4 | 1 | 4 | 5.0 | CN1CCCC(COc2c(-c3ccccc3)c(O)nc3cc(Cl)ccc23)C1 | 10.1016/s0960-894x(99)00446-1 | ||
44322302 | 204930 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89332 | 204930 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 5.7 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCCN2C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44391510 | 122424 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3cccc(OC)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL360693 | 122424 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3cccc(OC)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
67143420 | 162358 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4173938 | 162358 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 9 | 1 | 9 | 3.6 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
145948911 | 166923 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1304 | 29 | 16 | 15 | -1.1 | NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCCC1 | 10.1039/C5MD00259A | ||
CHEMBL4299453 | 166923 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1304 | 29 | 16 | 15 | -1.1 | NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCCC1 | 10.1039/C5MD00259A | ||
86275342 | 115686 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/ml5004469 | ||
CHEMBL3358413 | 115686 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/ml5004469 | ||
118179051 | 179638 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
11634198 | 186783 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493344 | 186783 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
44267278 | 9220 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 9 | 3 | 3 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11101 | 9220 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 9 | 3 | 3 | 5.6 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(N)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44402645 | 168558 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 528 | 9 | 3 | 8 | 4.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL440212 | 168558 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 528 | 9 | 3 | 8 | 4.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44402646 | 132913 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 9 | 3 | 8 | 6.1 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370587 | 132913 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 9 | 3 | 8 | 6.1 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
87285550 | 173756 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 775 | 13 | 3 | 9 | 5.4 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCP(=O)(O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4550720 | 173756 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 775 | 13 | 3 | 9 | 5.4 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCP(=O)(O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
71668147 | 179410 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 637 | 6 | 1 | 6 | 4.6 | O=C(NCc1ccc(C(F)(F)F)cn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4746969 | 179410 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 637 | 6 | 1 | 6 | 4.6 | O=C(NCc1ccc(C(F)(F)F)cn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
67143723 | 174826 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 656 | 9 | 2 | 8 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4575491 | 174826 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 656 | 9 | 2 | 8 | 3.8 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL406243 | 210853 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NC1(C(=O)N[C@H](CCCN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)CCC1 | 10.1021/jm990433g | ||||
44402463 | 127002 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 5.2 | CCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL366236 | 127002 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 5.2 | CCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
118178986 | 181617 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 555 | 5 | 1 | 4 | 4.5 | CC(=O)N1CCC2(CC1)CN(S(=O)(=O)c1ccc(F)cc1)c1ccc(C(=O)NCc3ccccc3Cl)cc12 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4782882 | 181617 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 555 | 5 | 1 | 4 | 4.5 | CC(=O)N1CCC2(CC1)CN(S(=O)(=O)c1ccc(F)cc1)c1ccc(C(=O)NCc3ccccc3Cl)cc12 | 10.1021/acs.jmedchem.0c01076 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
86272223 | 115688 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 737 | 7 | 1 | 7 | 6.0 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1cccc(OC(F)(F)F)c1 | 10.1021/ml5004469 | ||
CHEMBL3358415 | 115688 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 737 | 7 | 1 | 7 | 6.0 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1cccc(OC(F)(F)F)c1 | 10.1021/ml5004469 | ||
11525358 | 186759 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493185 | 186759 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
44444675 | 154184 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399857 | 154184 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44402293 | 71084 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccn1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196040 | 71084 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccn1 | 10.1016/j.bmcl.2005.03.030 | ||
86275345 | 181488 | 1 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4781434 | 181488 | 1 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
15602808 | 8025 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091580 | 8025 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5cnc6ccccc6n5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
162649425 | 179440 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 555 | 5 | 1 | 6 | 3.9 | O=C(Nc1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4747322 | 179440 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 555 | 5 | 1 | 6 | 3.9 | O=C(Nc1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL327359 | 209545 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NCC(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44359224 | 11524 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 565 | 10 | 2 | 5 | 7.8 | CCC(C)N(C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl)C(C)CC | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180706 | 11524 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 565 | 10 | 2 | 5 | 7.8 | CCC(C)N(C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl)C(C)CC | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138977 | 11524 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 565 | 10 | 2 | 5 | 7.8 | CCC(C)N(C(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl)C(C)CC | 10.1016/s0960-894x(00)00024-x | ||
44293165 | 101223 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL299392 | 101223 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 556 | 16 | 2 | 5 | 5.7 | COCCN(CCOC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3cccnc3)c2c1 | 10.1016/s0960-894x(01)00275-x | ||
44267275 | 97687 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 490 | 11 | 3 | 4 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL273625 | 97687 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 490 | 11 | 3 | 4 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44295820 | 101515 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2NCCCC2C)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL301501 | 101515 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2NCCCC2C)c1 | 10.1016/j.bmcl.2003.12.101 | ||
44402467 | 170089 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL445143 | 170089 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL410269 | 211063 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
11518185 | 187105 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 4 | 1 | 5 | 5.2 | Cc1nn(C)c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495190 | 187105 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 4 | 1 | 5 | 5.2 | Cc1nn(C)c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44267254 | 9189 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccccn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11087 | 9189 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 397 | 9 | 2 | 2 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccccn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44267271 | 9714 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 386 | 9 | 3 | 2 | 5.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2c[nH]cn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11375 | 9714 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 386 | 9 | 3 | 2 | 5.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2c[nH]cn2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
11318649 | 64023 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3F)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL181257 | 64023 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3F)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44561142 | 186121 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4ccc5[nH]c(=S)[nH]c5c4)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL488478 | 186121 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4ccc5[nH]c(=S)[nH]c5c4)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44267242 | 9957 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 355 | 6 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11523 | 9957 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 355 | 6 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44573791 | 186805 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493565 | 186805 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
145950097 | 162252 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 527 | 8 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4172391 | 162252 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 527 | 8 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
118178976 | 180599 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 595 | 6 | 1 | 4 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4761024 | 180599 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 595 | 6 | 1 | 4 | 5.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44573789 | 186757 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493167 | 186757 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.8 | CCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
15602807 | 8136 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092245 | 8136 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44572236 | 171333 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL446978 | 171333 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44267035 | 96763 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 504 | 12 | 4 | 3 | 5.5 | CNS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL268479 | 96763 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 504 | 12 | 4 | 3 | 5.5 | CNS(=O)(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
44402499 | 69480 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccncc1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193689 | 69480 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccncc1 | 10.1016/j.bmcl.2005.03.030 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44391499 | 65602 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 439 | 8 | 1 | 5 | 4.1 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183600 | 65602 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 439 | 8 | 1 | 5 | 4.1 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
162647697 | 179279 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 523 | 5 | 1 | 5 | 5.2 | O=C(Nc1ccc2c(c1)C1(CCSCC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4745391 | 179279 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 523 | 5 | 1 | 5 | 5.2 | O=C(Nc1ccc2c(c1)C1(CCSCC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
53239184 | 169034 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 652 | 8 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3nc4ccccc4s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436375 | 169034 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 652 | 8 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3nc4ccccc4s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44267054 | 9702 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 468 | 10 | 4 | 2 | 6.4 | CNC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11368 | 9702 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 468 | 10 | 4 | 2 | 6.4 | CNC(=O)Nc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cc1 | 10.1016/s0960-894x(01)00134-2 | ||
67144478 | 169783 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3ccc(F)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4447332 | 169783 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 8 | 1 | 7 | 3.8 | Cc1c(N2CCN(Cc3ccc(F)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
90663998 | 106346 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 787 | 14 | 4 | 10 | 4.9 | O=C(NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1)[C@H](CC1=CNCN1)NC(=O)[C@@H]1CCCN1C(=O)OCC(c1ccccc1)c1ccccc1 | 10.1021/jm00129a003 | ||
CHEMBL3144569 | 106346 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 787 | 14 | 4 | 10 | 4.9 | O=C(NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1)[C@H](CC1=CNCN1)NC(=O)[C@@H]1CCCN1C(=O)OCC(c1ccccc1)c1ccccc1 | 10.1021/jm00129a003 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44387961 | 165468 | 0 | None | 144 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL425523 | 165468 | 0 | None | 144 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44391510 | 122424 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3cccc(OC)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL360693 | 122424 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3cccc(OC)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
162667361 | 181943 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4787218 | 181943 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 468 | 5 | 1 | 3 | 5.1 | CC1N(S(=O)(=O)c2ccccc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C1(C)C | 10.1021/acs.jmedchem.0c01076 | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573791 | 186805 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493565 | 186805 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 6.2 | CCCCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44573276 | 186833 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493731 | 186833 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
11226753 | 63014 | 0 | None | 389 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL179429 | 63014 | 0 | None | 389 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
87285708 | 173333 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 749 | 13 | 2 | 8 | 6.1 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4540232 | 173333 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 749 | 13 | 2 | 8 | 6.1 | Cc1c(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
145957335 | 161755 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 7 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)C3CCSCC3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4164417 | 161755 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 7 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)C3CCSCC3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44402646 | 132913 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 570 | 9 | 3 | 8 | 6.1 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370587 | 132913 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 570 | 9 | 3 | 8 | 6.1 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44391628 | 65541 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 513 | 10 | 1 | 7 | 4.4 | CCOC(=O)CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183572 | 65541 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 513 | 10 | 1 | 7 | 4.4 | CCOC(=O)CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44391754 | 168108 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 9 | 3 | 5 | 4.2 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL436472 | 168108 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 9 | 3 | 5 | 4.2 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
53239184 | 169034 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 652 | 8 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3nc4ccccc4s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436375 | 169034 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 652 | 8 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3nc4ccccc4s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44444641 | 154430 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401212 | 154430 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 7 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143715 | 172916 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4530350 | 172916 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3cccc(C#N)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44305604 | 201724 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 625 | 11 | 1 | 8 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)C4CC4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL65614 | 201724 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 625 | 11 | 1 | 8 | 5.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)C4CC4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
44292919 | 100676 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL295376 | 100676 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44293305 | 100991 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL297703 | 100991 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 11 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCCC4)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44292990 | 100728 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCN(CCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL295731 | 100728 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 616 | 16 | 3 | 4 | 7.2 | CCCN(CCC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293178 | 100952 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL297430 | 100952 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 658 | 17 | 3 | 4 | 7.9 | CCCN(CCC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44292979 | 187606 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 483 | 10 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL49893 | 187606 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 483 | 10 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44348173 | 169913 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1533 | 39 | 15 | 17 | 1.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL444903 | 169913 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1533 | 39 | 15 | 17 | 1.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](NC(C)=O)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
67143432 | 171561 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ncccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4472942 | 171561 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ncccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
11526254 | 187030 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 504 | 5 | 1 | 7 | 4.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccnc(S(C)(=O)=O)n5)CC4)cccc3[nH]2)cc1 | 10.1021/jm701249f | ||
CHEMBL494797 | 187030 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 504 | 5 | 1 | 7 | 4.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccnc(S(C)(=O)=O)n5)CC4)cccc3[nH]2)cc1 | 10.1021/jm701249f | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44321695 | 105501 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccn(C)c2=O)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL313086 | 105501 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 592 | 9 | 2 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2cccn(C)c2=O)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44348310 | 157279 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm970024p | ||
CHEMBL408335 | 157279 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)N(C)C(=O)c2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm970024p | ||
155531714 | 175617 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
145952094 | 162355 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 523 | 7 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccc(C)cc3C)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4173914 | 162355 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 523 | 7 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccc(C)cc3C)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
86275573 | 115689 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 687 | 6 | 1 | 6 | 5.8 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/ml5004469 | ||
CHEMBL3358416 | 115689 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 687 | 6 | 1 | 6 | 5.8 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/ml5004469 | ||
44561397 | 189232 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL516479 | 189232 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 458 | 4 | 3 | 5 | 3.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44348418 | 96197 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1559 | 41 | 13 | 16 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL263629 | 96197 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 1559 | 41 | 13 | 16 | 3.5 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(C)=O)N(C)C=O)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
44321510 | 106655 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 608 | 15 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL316159 | 106655 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 608 | 15 | 2 | 3 | 9.0 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44572236 | 171333 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL446978 | 171333 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 599 | 6 | 2 | 7 | 5.3 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6[nH]c(=O)c(=O)n(Cc7cccnc7)c6c5)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44561369 | 189874 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL517881 | 189874 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
15602805 | 8023 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091579 | 8023 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 486 | 5 | 1 | 7 | 3.5 | CCn1cc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(=O)[nH]c1=O | 10.1016/j.bmcl.2010.02.099 | ||
44292888 | 174206 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 567 | 14 | 3 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45614 | 174206 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 567 | 14 | 3 | 3 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44295630 | 190234 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 559 | 8 | 3 | 7 | 6.6 | CCC1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc23)N1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL51841 | 190234 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 559 | 8 | 3 | 7 | 6.6 | CCC1CCC[C@@H](CCOc2c(-c3cc(C)cc(C)c3)c(O)nc3cc(Cl)c(C(=O)Nc4ccncn4)cc23)N1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
24825725 | 192027 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL521674 | 192027 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
9979079 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
15462657 | 79813 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 9 | 0 | 7 | 6.8 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21373 | 79813 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 9 | 0 | 7 | 6.8 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
9979079 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
25193798 | 169631 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL444509 | 169631 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
9979079 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL10931 | 8279 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44267231 | 9505 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 10 | 2 | 2 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11253 | 9505 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 10 | 2 | 2 | 6.4 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44391735 | 121823 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 591 | 10 | 3 | 5 | 5.7 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1Cl | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL359914 | 121823 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 591 | 10 | 3 | 5 | 5.7 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1Cl | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44365420 | 40979 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1ccccc1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL148884 | 40979 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1ccccc1-c1[nH]c2ccccc2c1CCNCCCCc1ccc(O)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
90663997 | 106345 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 849 | 14 | 6 | 11 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CNCN1)C(=O)NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 | 10.1021/jm00129a003 | ||
CHEMBL3144568 | 106345 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 849 | 14 | 6 | 11 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CNCN1)C(=O)NC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 | 10.1021/jm00129a003 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44322401 | 106068 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 396 | 4 | 2 | 4 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCNC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL314147 | 106068 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 396 | 4 | 2 | 4 | 5.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCCNC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44322444 | 204906 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89186 | 204906 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 396 | 4 | 1 | 4 | 5.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC2CCN(C)C2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
11570616 | 77903 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 506 | 9 | 0 | 8 | 5.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)C)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL210845 | 77903 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 506 | 9 | 0 | 8 | 5.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)C)c2c1=O | 10.1021/jm0512894 | ||
44412978 | 79348 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3cccc(OC)c3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL211752 | 79348 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3cccc(OC)c3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44267086 | 97626 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 441 | 10 | 2 | 3 | 6.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc([N+](=O)[O-])cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL273296 | 97626 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 441 | 10 | 2 | 3 | 6.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc([N+](=O)[O-])cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
10603202 | 168037 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 573 | 9 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL435974 | 168037 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 573 | 9 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
44365118 | 41308 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 473 | 12 | 2 | 5 | 5.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc([N+](=O)[O-])cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149124 | 41308 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 473 | 12 | 2 | 5 | 5.9 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc([N+](=O)[O-])cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
11511860 | 138804 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 8 | 0 | 7 | 5.1 | CCOC(=O)c1cn(C)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL379274 | 138804 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 8 | 0 | 7 | 5.1 | CCOC(=O)c1cn(C)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44573113 | 192635 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523711 | 192635 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nc1C | 10.1016/j.bmcl.2009.02.043 | ||
44444665 | 93767 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249772 | 93767 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444652 | 94066 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL251578 | 94066 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44402466 | 71541 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197089 | 71541 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44391693 | 63436 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 9 | 3 | 5 | 5.4 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(C(F)(F)F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL180167 | 63436 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 9 | 3 | 5 | 5.4 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(C(F)(F)F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
67144162 | 174481 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 657 | 9 | 1 | 8 | 4.3 | Cc1c(N2CCN(Cc3cccc([S+](C)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4567854 | 174481 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 657 | 9 | 1 | 8 | 4.3 | Cc1c(N2CCN(Cc3cccc([S+](C)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44402403 | 71185 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 9 | 3 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)O)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196288 | 71185 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 9 | 3 | 8 | 5.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)O)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44561141 | 192897 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL527422 | 192897 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
87285768 | 169927 | 1 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
25193700 | 172711 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452547 | 172711 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 534 | 7 | 2 | 5 | 5.9 | CCc1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
87285521 | 174447 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccnc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4567165 | 174447 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccnc3Cl)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44444644 | 154460 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 6 | 1 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(C(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401350 | 154460 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 6 | 1 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(C(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
67143487 | 170196 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 662 | 9 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3cccc(-c4ncco4)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4452636 | 170196 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 662 | 9 | 1 | 9 | 5.2 | Cc1c(N2CCN(Cc3cccc(-c4ncco4)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
123549935 | 178854 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 4.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccccc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740379 | 178854 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 551 | 5 | 1 | 4 | 4.7 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccccc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
162672599 | 182425 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 481 | 4 | 1 | 5 | 4.1 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(NC(=O)c3cccnc3)cc2C12CCOCC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4793643 | 182425 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 481 | 4 | 1 | 5 | 4.1 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(NC(=O)c3cccnc3)cc2C12CCOCC2 | 10.1021/acs.jmedchem.0c01076 | ||
44391703 | 167938 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 575 | 10 | 3 | 5 | 5.2 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1F | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL435334 | 167938 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 575 | 10 | 3 | 5 | 5.2 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1F | 10.1016/j.bmcl.2004.10.090 | ||
162665107 | 181554 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ncccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4782228 | 181554 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 570 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ncccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44391526 | 122091 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 560 | 12 | 2 | 6 | 5.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCNCc1ccccc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL360244 | 122091 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 560 | 12 | 2 | 6 | 5.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCNCc1ccccc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
86275342 | 115686 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL3358413 | 115686 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | O=C(NCc1ncc(Cl)cc1C(F)(F)F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44402465 | 134712 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL372455 | 134712 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44391821 | 65250 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CC(C)(C)OC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183197 | 65250 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CC(C)(C)OC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
67143432 | 171561 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ncccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4472942 | 171561 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1ncccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
127037454 | 136940 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1250 | 31 | 17 | 15 | -2.5 | CC(C)C[C@H](NC(=O)C1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
CHEMBL3753755 | 136940 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 1250 | 31 | 17 | 15 | -2.5 | CC(C)C[C@H](NC(=O)C1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
9918188 | 154183 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399856 | 154183 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 708 | 8 | 2 | 5 | 8.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444649 | 154466 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401418 | 154466 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44293164 | 167268 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 482 | 11 | 3 | 3 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL430763 | 167268 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 482 | 11 | 3 | 3 | 6.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)NC(C)C)cc3c2CCNCCCCc2cccnc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
44402670 | 71614 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 557 | 11 | 4 | 9 | 4.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCN)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197317 | 71614 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 557 | 11 | 4 | 9 | 4.3 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCN)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL318127 | 209465 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](CCCCN)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44573626 | 186949 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494416 | 186949 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 457 | 5 | 1 | 5 | 5.7 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)o1 | 10.1016/j.bmcl.2009.02.043 | ||
118179174 | 181894 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 561 | 6 | 1 | 4 | 4.6 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4786609 | 181894 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 561 | 6 | 1 | 4 | 4.6 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
87285732 | 172383 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3ccc(Cl)nc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4517137 | 172383 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 630 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3ccc(Cl)nc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
118178989 | 180572 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccc(Cl)cc4)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4760799 | 180572 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccc(Cl)cc4)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44444635 | 154166 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399779 | 154166 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 637 | 7 | 2 | 4 | 8.0 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44402472 | 132300 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370145 | 132300 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 619 | 12 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCc3ccccn3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
162645007 | 178881 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573278 | 186864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493932 | 186864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
44573277 | 186863 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493931 | 186863 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 498 | 7 | 1 | 5 | 6.3 | CCCn1c(CC)nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44267239 | 96663 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 413 | 9 | 3 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL267558 | 96663 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 413 | 9 | 3 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)nc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
44293285 | 162225 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cncnc4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
CHEMBL417189 | 162225 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 7 | 4 | 7 | 6.2 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(NC(=O)Nc4cncnc4)cc3c2OCC[C@@H]2CCCCN2)c1 | 10.1016/s0960-894x(00)00318-8 | ||
44402057 | 71594 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.8 | COCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL197254 | 71594 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.8 | COCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44391693 | 63436 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 9 | 3 | 5 | 5.4 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(C(F)(F)F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL180167 | 63436 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 9 | 3 | 5 | 5.4 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(C(F)(F)F)c(F)c3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
162645007 | 178881 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44402672 | 71291 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 420 | 7 | 1 | 6 | 5.1 | COc1ccc(C#N)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196351 | 71291 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 420 | 7 | 1 | 6 | 5.1 | COc1ccc(C#N)cc1CSc1nc2cc(NC(=O)C3CC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44573112 | 187015 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.9 | CCCCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494739 | 187015 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 484 | 7 | 1 | 5 | 5.9 | CCCCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
11583388 | 8206 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 457 | 5 | 2 | 5 | 4.8 | CCc1nc(CN2CCN(c3cncc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092626 | 8206 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 457 | 5 | 2 | 5 | 4.8 | CCc1nc(CN2CCN(c3cncc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
162650892 | 179649 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749974 | 179649 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 554 | 5 | 2 | 6 | 4.5 | N=S1(=O)CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44561141 | 192897 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL527422 | 192897 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 3 | 3 | 4 | 4.4 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44391498 | 165567 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 524 | 10 | 1 | 7 | 3.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(OCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL426060 | 165567 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 524 | 10 | 1 | 7 | 3.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(OCCN1CCOCC1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
118179127 | 182632 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 599 | 7 | 2 | 5 | 4.2 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2CCO | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4795998 | 182632 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 599 | 7 | 2 | 5 | 4.2 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2CCO | 10.1021/acs.jmedchem.0c01076 | ||
127036617 | 137017 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1236 | 31 | 17 | 15 | -2.9 | CC(C)C[C@H](NC(=O)C1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
CHEMBL3754384 | 137017 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1236 | 31 | 17 | 15 | -2.9 | CC(C)C[C@H](NC(=O)C1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCC(=O)N2)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
155531714 | 175617 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
44365609 | 39466 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 618 | 11 | 3 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(S(C)(=O)=O)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL147537 | 39466 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 618 | 11 | 3 | 6 | 5.4 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(S(C)(=O)=O)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm060580w | ||
44293366 | 161662 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL416285 | 161662 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 511 | 12 | 3 | 3 | 6.8 | CCN(CC)C(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
44293236 | 174307 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 560 | 13 | 4 | 4 | 5.7 | CCNC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL45639 | 174307 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 560 | 13 | 4 | 4 | 5.7 | CCNC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1 | 10.1016/s0960-894x(01)00274-8 | ||
10674894 | 25336 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL135103 | 25336 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL438652 | 212037 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(N)=O | 10.1021/jm0512894 | ||||
10674894 | 25336 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL135103 | 25336 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
11980076 | 206711 | 27 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
CHEMBL1007 | 206711 | 27 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
44321497 | 97642 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 665 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL273390 | 97642 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 665 | 11 | 2 | 5 | 7.9 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)cc3c2[C@H](C)CNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00512-1 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11496945 | 175901 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL459659 | 175901 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 496 | 4 | 3 | 4 | 6.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=S)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
145957893 | 161521 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 545 | 8 | 1 | 6 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cc(F)cc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4160683 | 161521 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 545 | 8 | 1 | 6 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cc(F)cc(F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
11455317 | 62559 | 0 | None | 851 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL178457 | 62559 | 0 | None | 851 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44402396 | 161130 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1663 | 44 | 18 | 19 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CCC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL413216 | 161130 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1663 | 44 | 18 | 19 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CCC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
44402397 | 161318 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1578 | 42 | 17 | 18 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL414899 | 161318 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1578 | 42 | 17 | 18 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
87285768 | 169927 | 1 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4449332 | 169927 | 1 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 739 | 13 | 2 | 9 | 5.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)o3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44402397 | 161318 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1578 | 42 | 17 | 18 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL414899 | 161318 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1578 | 42 | 17 | 18 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)C(N)CN)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11180219 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL326504 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
67142995 | 169759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 585 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3ccoc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446997 | 169759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 585 | 8 | 1 | 8 | 4.1 | Cc1c(N2CCN(Cc3ccoc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44577104 | 178169 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1021/jm701249f | ||
CHEMBL468565 | 178169 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 2 | 4 | 5.4 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1021/jm701249f | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
11532637 | 7633 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1088866 | 7633 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 0 | 6 | 5.1 | CCn1cnc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2010.02.099 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67144450 | 171743 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4475210 | 171743 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 570 | 8 | 1 | 8 | 3.5 | Cc1c(N2CCN(Cc3ccccc3C#N)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44402396 | 161130 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1663 | 44 | 18 | 19 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CCC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
CHEMBL413216 | 161130 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1663 | 44 | 18 | 19 | 1.8 | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)NC(=O)[C@H](N)CCC(N)=O)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O | 10.1016/j.bmcl.2005.03.085 | ||
67143570 | 171191 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 726 | 14 | 2 | 10 | 5.0 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4467407 | 171191 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 726 | 14 | 2 | 10 | 5.0 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
71623059 | 180243 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4756920 | 180243 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(01)00779-x | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm701249f | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1021/jm000275p | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm049218c | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm0512894 | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm020180i | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1021/jm9803673 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44365078 | 41213 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 10 | 3 | 3 | 5.7 | COc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149062 | 41213 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 10 | 3 | 3 | 5.7 | COc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44365456 | 42548 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 440 | 11 | 3 | 2 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL150223 | 42548 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 440 | 11 | 3 | 2 | 7.1 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44292915 | 182309 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 590 | 12 | 3 | 4 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)O)cc3c2CCN(CCCCc2ccc(O)cc2)C(=O)OCc2ccccc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL47921 | 182309 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 590 | 12 | 3 | 4 | 8.1 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)O)cc3c2CCN(CCCCc2ccc(O)cc2)C(=O)OCc2ccccc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
44402378 | 69333 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 457 | 8 | 2 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193529 | 69333 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 457 | 8 | 2 | 7 | 5.4 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44391612 | 63168 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 471 | 9 | 2 | 6 | 3.8 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCO)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL179977 | 63168 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 471 | 9 | 2 | 6 | 3.8 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCO)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44365170 | 40211 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 10 | 3 | 4 | 5.3 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL148245 | 40211 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 10 | 3 | 4 | 5.3 | COc1ccc(-c2[nH]c3ccccc3c2CCNCCCc2ccc(O)cc2)cc1OC | 10.1016/s0960-894x(00)00707-1 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
67144531 | 172582 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 638 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(C#N)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4521484 | 172582 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 638 | 8 | 1 | 8 | 4.6 | Cc1c(N2CCN(Cc3cccc(C#N)c3F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
162670223 | 181989 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 521 | 5 | 2 | 5 | 4.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4787856 | 181989 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 521 | 5 | 2 | 5 | 4.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573790 | 192659 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 470 | 5 | 1 | 5 | 5.9 | Cc1c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)ncn1C(C)C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL523849 | 192659 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 470 | 5 | 1 | 5 | 5.9 | Cc1c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)ncn1C(C)C | 10.1016/j.bmcl.2009.02.043 | ||
44402464 | 168523 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL439860 | 168523 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3ccncc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
44402404 | 133041 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 568 | 9 | 2 | 8 | 5.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N3CCCC3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL371073 | 133041 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 568 | 9 | 2 | 8 | 5.8 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)N3CCCC3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
87285668 | 173147 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 669 | 8 | 1 | 8 | 5.6 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4536130 | 173147 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 669 | 8 | 1 | 8 | 5.6 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)s3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44444672 | 168836 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL442283 | 168836 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 630 | 8 | 1 | 5 | 6.4 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
44402538 | 167871 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 7 | 2 | 7 | 5.7 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL434955 | 167871 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 7 | 2 | 7 | 5.7 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402538 | 167871 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 7 | 2 | 7 | 5.7 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL434955 | 167871 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 7 | 2 | 7 | 5.7 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
145954593 | 161983 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 561 | 8 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3ccc(F)cc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4167945 | 161983 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 561 | 8 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3ccc(F)cc3Cl)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44296134 | 187814 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCC(C)CN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL50182 | 187814 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 5.9 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2CCC(C)CN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44402232 | 71067 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 454 | 8 | 1 | 7 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CCC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195920 | 71067 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 454 | 8 | 1 | 7 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)C3CCC3)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44561265 | 172538 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 5.0 | FC(F)(F)C(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL452044 | 172538 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 5.0 | FC(F)(F)C(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44322336 | 105660 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC(C)CN(C)C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL313517 | 105660 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.5 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCC(C)CN(C)C)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44402462 | 69562 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 399 | 6 | 1 | 4 | 5.9 | CC(C)n1c(SCc2ccccc2Cl)nc2cc(NC(=O)C3CC3)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL193897 | 69562 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 399 | 6 | 1 | 4 | 5.9 | CC(C)n1c(SCc2ccccc2Cl)nc2cc(NC(=O)C3CC3)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
67144164 | 173314 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 643 | 9 | 1 | 10 | 3.9 | COC(=O)c1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)o1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4539811 | 173314 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 643 | 9 | 1 | 10 | 3.9 | COC(=O)c1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)o1 | 10.1021/acs.jmedchem.6b01071 | ||
44215908 | 93794 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249982 | 93794 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 616 | 7 | 1 | 5 | 6.1 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44444630 | 154285 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400390 | 154285 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44561108 | 185848 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL487627 | 185848 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
71666542 | 179767 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 621 | 6 | 1 | 6 | 4.4 | O=C(NCc1ncc(F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4751345 | 179767 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 621 | 6 | 1 | 6 | 4.4 | O=C(NCc1ncc(F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
67143743 | 170739 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 559 | 8 | 1 | 7 | 4.0 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cc1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4460966 | 170739 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 559 | 8 | 1 | 7 | 4.0 | Cc1ccc(CN2CCN(c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)cc1 | 10.1021/acs.jmedchem.6b01071 | ||
67144486 | 170673 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4459812 | 170673 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccccc3C(F)(F)F)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
67143407 | 170201 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4452793 | 170201 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 613 | 8 | 1 | 7 | 4.7 | Cc1c(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44402377 | 132918 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 5.6 | Cc1cccc(CSc2nc3cc(NC(=O)C4CC4)ccc3n2C(C)C)c1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370603 | 132918 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 5.6 | Cc1cccc(CSc2nc3cc(NC(=O)C4CC4)ccc3n2C(C)C)c1 | 10.1016/j.bmcl.2005.03.030 | ||
44391703 | 167938 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 575 | 10 | 3 | 5 | 5.2 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1F | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL435334 | 167938 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 575 | 10 | 3 | 5 | 5.2 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1F | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
162645007 | 178881 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44402293 | 71084 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccn1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL196040 | 71084 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 520 | 8 | 2 | 8 | 5.6 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1Cc1ccccn1 | 10.1016/j.bmcl.2005.03.030 | ||
44391526 | 122091 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 560 | 12 | 2 | 6 | 5.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCNCc1ccccc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL360244 | 122091 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 560 | 12 | 2 | 6 | 5.6 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCCNCc1ccccc1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
86272223 | 115688 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 737 | 7 | 1 | 7 | 6.0 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1cccc(OC(F)(F)F)c1 | 10.1021/ml5004469 | ||
CHEMBL3358415 | 115688 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 737 | 7 | 1 | 7 | 6.0 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1cccc(OC(F)(F)F)c1 | 10.1021/ml5004469 | ||
118179235 | 181353 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 548 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4779806 | 181353 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 548 | 5 | 1 | 5 | 4.3 | CC(=O)N1CCC2(CC1)c1cc(NC(=O)c3cccnc3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
44573714 | 187103 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 442 | 4 | 2 | 4 | 5.2 | Cc1n[nH]c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL495189 | 187103 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 442 | 4 | 2 | 4 | 5.2 | Cc1n[nH]c(C)c1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
44561368 | 176240 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460892 | 176240 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44573275 | 186832 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.6 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1CC | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493730 | 186832 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.6 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1CC | 10.1016/j.bmcl.2009.02.043 | ||
44402465 | 134712 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL372455 | 134712 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 605 | 11 | 3 | 9 | 5.9 | CCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCc3cccnc3)c21 | 10.1016/j.bmcl.2005.03.030 | ||
145949379 | 162164 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 496 | 7 | 1 | 7 | 3.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cccnc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4170863 | 162164 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 496 | 7 | 1 | 7 | 3.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cccnc3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44391734 | 122103 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 509 | 10 | 3 | 5 | 3.6 | CCNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL360297 | 122103 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 509 | 10 | 3 | 5 | 3.6 | CCNC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44391692 | 63969 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 437 | 7 | 1 | 4 | 4.8 | CC(C)c1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL181057 | 63969 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 437 | 7 | 1 | 4 | 4.8 | CC(C)c1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44444644 | 154460 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 601 | 6 | 1 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(C(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401350 | 154460 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 601 | 6 | 1 | 4 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(C(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44365844 | 41686 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 646 | 12 | 3 | 6 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(S(=O)(=O)C(C)C)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL149447 | 41686 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 646 | 12 | 3 | 6 | 6.2 | Cc1cc(C)cc(-c2[nH]c3ccc(OC(=O)N4CCN(S(=O)(=O)C(C)C)CC4)cc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00708-3 | ||
CHEMBL97265 | 214146 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
24825725 | 192027 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL521674 | 192027 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.4 | CCn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1C | 10.1016/j.bmcl.2009.02.043 | ||
44305274 | 102296 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 11 | 1 | 9 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccsc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
CHEMBL305155 | 102296 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 667 | 11 | 1 | 9 | 6.6 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)c4ccsc4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00372-4 | ||
44293222 | 175387 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL138464 | 175387 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL45883 | 175387 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 531 | 7 | 3 | 7 | 5.8 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c(C(=O)Nc4cnccn4)cc3c2OCCC2CCCCN2)c1 | 10.1016/s0960-894x(00)00024-x | ||
11525358 | 186759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmc.2012.09.013 | ||
CHEMBL493185 | 186759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmc.2012.09.013 | ||
10074296 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00274-8 | ||
CHEMBL438652 | 212037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(N)=O | 10.1021/jm0512894 | ||||
10074296 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00134-2 | ||
10074296 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
10074296 | 9298 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL11149 | 9298 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 489 | 11 | 3 | 3 | 6.0 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(NS(C)(=O)=O)cc2)c1 | 10.1016/s0960-894x(01)00779-x | ||
11980076 | 206711 | 27 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
CHEMBL1007 | 206711 | 27 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm9803673 | ||||
67144646 | 172566 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 586 | 8 | 1 | 9 | 3.5 | Cc1c(N2CCN(Cc3cocn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4521118 | 172566 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 586 | 8 | 1 | 9 | 3.5 | Cc1c(N2CCN(Cc3cocn3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
155559612 | 174311 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1612 | 43 | 20 | 24 | -4.1 | CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CCCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
CHEMBL4563936 | 174311 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 1612 | 43 | 20 | 24 | -4.1 | CC(C)C[C@H](NC(=O)[C@H](CCCCNC(=O)CCCC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2019.01.041 | ||
44292918 | 170849 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL44627 | 170849 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 552 | 14 | 2 | 3 | 7.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)N(CC(C)C)CC(C)C)cc3c2CCNCCCCc2ccncc2)c1 | 10.1016/s0960-894x(01)00275-x | ||
67143413 | 169050 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1cncc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4436711 | 169050 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 610 | 8 | 1 | 8 | 4.3 | Cc1cncc(CN2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)CC2)c1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
70691201 | 77300 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 1952 | 47 | 22 | 28 | -0.7 | CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CO/N=C(\C)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2088506 | 77300 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 1952 | 47 | 22 | 28 | -0.7 | CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CO/N=C(\C)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2012.08.014 | ||
11604354 | 186941 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494400 | 186941 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.9 | Cc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c[nH]1 | 10.1016/j.bmcl.2009.02.043 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
145952802 | 162047 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cccc(OC(F)(F)F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4169027 | 162047 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 579 | 8 | 1 | 7 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3cccc(OC(F)(F)F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
CHEMBL94842 | 214135 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44417614 | 141086 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10722009 | 116053 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL336319 | 116053 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
44295982 | 187716 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 6 | 2 | 6 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2Cc3ccccc3CN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL50035 | 187716 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 6 | 2 | 6 | 6.3 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@@H]2Cc3ccccc3CN2)c1 | 10.1016/j.bmcl.2003.12.101 | ||
10722009 | 116053 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL336319 | 116053 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 582 | 11 | 0 | 8 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
44365281 | 42552 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 444 | 11 | 3 | 4 | 5.7 | COc1cc(OC)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL150228 | 42552 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 444 | 11 | 3 | 4 | 5.7 | COc1cc(OC)cc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
15462665 | 168094 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 615 | 9 | 0 | 7 | 7.4 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(C2CCCCC2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL436346 | 168094 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 615 | 9 | 0 | 7 | 7.4 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(C2CCCCC2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44412876 | 77557 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccccc3OC)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL209419 | 77557 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 552 | 10 | 0 | 7 | 6.6 | CCOC(=O)c1cn(Cc2ccccc2)c2sc(-c3ccccc3OC)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
10985312 | 78336 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21126 | 78336 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
44322390 | 204884 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 5.1 | CN1CCCCC(Oc2c(-c3ccccc3)c(O)nc3cc(Cl)ccc23)C1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89041 | 204884 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 382 | 3 | 1 | 4 | 5.1 | CN1CCCCC(Oc2c(-c3ccccc3)c(O)nc3cc(Cl)ccc23)C1 | 10.1016/s0960-894x(99)00446-1 | ||
11512807 | 139606 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 610 | 11 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(Cc3ccccc3)C(C)=O)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL380200 | 139606 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 610 | 11 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2OC)c2sc(-c3ccc(OC)cc3)c(CN(Cc3ccccc3)C(C)=O)c2c1=O | 10.1021/jm0512894 | ||
44573507 | 186971 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 428 | 4 | 1 | 4 | 5.8 | Cc1ccc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494548 | 186971 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 428 | 4 | 1 | 4 | 5.8 | Cc1ccc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
11496610 | 4012 | 11 | None | - | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
5582 | 4012 | 11 | None | - | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
CHEMBL474991 | 4012 | 11 | None | - | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1021/jm801572m | ||
25193798 | 169631 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL444509 | 169631 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 562 | 6 | 2 | 5 | 6.6 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44402038 | 69864 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 472 | 7 | 1 | 8 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)OC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL194074 | 69864 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 472 | 7 | 1 | 8 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)OC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
162675445 | 182826 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4798298 | 182826 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 470 | 6 | 1 | 4 | 4.4 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3CC2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL2370256 | 208075 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm990433g | ||||
44561369 | 189874 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL517881 | 189874 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 508 | 4 | 3 | 5 | 4.4 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
11496610 | 4012 | 11 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
5582 | 4012 | 11 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL474991 | 4012 | 11 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 476 | 4 | 1 | 5 | 5.8 | CC(c1ccc(cc1)c1[nH]c2c(n1)cccc2N1CCN(CC1)Cc1ccc2c(c1)nccn2)(C)C | 10.1016/j.bmcl.2010.02.099 | ||
44391613 | 167712 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 462 | 9 | 1 | 7 | 2.4 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1CCN1CCOCC1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL433954 | 167712 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 462 | 9 | 1 | 7 | 2.4 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1CCN1CCOCC1 | 10.1016/j.bmcl.2004.10.089 | ||
127036774 | 136984 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1146 | 25 | 12 | 13 | -1.5 | CC(C)C[C@H](NC(=O)CN1CN(c2ccccc2)C2(CCN(C(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@@H]3CCC(=O)N3)CC2)C1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
CHEMBL3754120 | 136984 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1146 | 25 | 12 | 13 | -1.5 | CC(C)C[C@H](NC(=O)CN1CN(c2ccccc2)C2(CCN(C(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@@H]3CCC(=O)N3)CC2)C1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1039/C5MD00259A | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
145949556 | 162383 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccco3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4174298 | 162383 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccco3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
67142794 | 173551 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 8 | 1 | 7 | 4.0 | Cc1ccccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4545859 | 173551 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 8 | 1 | 7 | 4.0 | Cc1ccccc1CN1CCN(c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)CC1 | 10.1021/acs.jmedchem.6b01071 | ||
162645007 | 178881 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740709 | 178881 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 6 | 1 | 4 | 5.2 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C(C)(C)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL428619 | 211713 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44444649 | 154466 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401418 | 154466 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 646 | 10 | 3 | 7 | 4.4 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(O)CN3CCNCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44185958 | 154459 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL401349 | 154459 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 615 | 8 | 1 | 5 | 5.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCN(CC(=O)N3CCCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44573586 | 186918 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 443 | 4 | 1 | 5 | 5.5 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494232 | 186918 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 443 | 4 | 1 | 5 | 5.5 | Cc1nc(C)c(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)o1 | 10.1016/j.bmcl.2009.02.043 | ||
44391821 | 65250 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CC(C)(C)OC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183197 | 65250 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CC(C)(C)OC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
67143567 | 170703 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 3.6 | Cc1c(N2CCC(C)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4460413 | 170703 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 3.6 | Cc1c(N2CCC(C)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44295833 | 167347 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 503 | 6 | 2 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2NCCc3ccccc32)c1 | 10.1016/j.bmcl.2003.12.101 | ||
CHEMBL431344 | 167347 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 503 | 6 | 2 | 6 | 6.4 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCCC2NCCc3ccccc32)c1 | 10.1016/j.bmcl.2003.12.101 | ||
11318649 | 64023 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3F)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL181257 | 64023 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 537 | 9 | 3 | 5 | 4.3 | CC(C)(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccccc3F)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44322434 | 110928 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 424 | 6 | 1 | 4 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCCN2CCCCC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL327323 | 110928 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 424 | 6 | 1 | 4 | 6.1 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)ccc3c2OCCCN2CCCCC2)c1 | 10.1016/s0960-894x(99)00446-1 | ||
44444673 | 93847 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250389 | 93847 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 644 | 8 | 1 | 5 | 6.8 | COC1CCN(C(=O)C2CCN(CCc3c(-c4cc(C)cc(C)c4)[nH]c4sc(C(C)(C)C(=O)N5C6CCC5CC6)cc34)CC2)CC1 | 10.1016/j.bmcl.2007.09.099 | ||
118179169 | 179346 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.4 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccc(F)cc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4746174 | 179346 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 613 | 6 | 1 | 4 | 5.4 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccc(F)cc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
162656174 | 180292 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 5 | 2 | 5 | 5.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)(C(F)(F)F)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4757424 | 180292 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 589 | 5 | 2 | 5 | 5.6 | O=C(Nc1ccc2c(c1)C1(CCC(O)(C(F)(F)F)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1)c1cccnc1 | 10.1021/acs.jmedchem.0c01076 | ||
44573111 | 187014 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494738 | 187014 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.1 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)cn1C | 10.1016/j.bmcl.2009.02.043 | ||
44444628 | 93883 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL250568 | 93883 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 722 | 8 | 2 | 5 | 8.8 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N/C(=O)OC(C)C)N2CCC(c3ccncc3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44402616 | 70792 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 7 | 2 | 7 | 5.5 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C1CC1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195516 | 70792 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 7 | 2 | 7 | 5.5 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C1CC1 | 10.1016/j.bmcl.2005.03.030 | ||
44391718 | 65274 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 523 | 10 | 3 | 5 | 4.0 | CC(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL183325 | 65274 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 523 | 10 | 3 | 5 | 4.0 | CC(C)NC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
44593415 | 188790 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL512893 | 188790 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
44573276 | 186833 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL493731 | 186833 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 484 | 6 | 1 | 5 | 5.9 | CCc1nc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)n1CC | 10.1016/j.bmcl.2009.02.043 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44444626 | 154344 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400739 | 154344 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 680 | 7 | 2 | 5 | 7.6 | COC(=O)/N=C(/NC[C@@H](C)c1c(-c2cc(C)cc(C)c2)[nH]c2sc(C(C)(C)C(=O)N3C4CCC3CC4)cc12)N1CCC(c2ccncc2)C1 | 10.1016/j.bmcl.2007.09.099 | ||
11592658 | 79341 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)NC(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL211731 | 79341 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)NC(C)C)cn3Cc2c(F)cccc2F)cc1 | 10.1021/jm0512894 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44341186 | 9949 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 606 | 10 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(=O)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL115192 | 9949 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 606 | 10 | 3 | 4 | 7.2 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4CC5CCC4CC5)cc3c2[C@H](C)CNCCc2ccnc(C(=O)O)c2)c1 | 10.1016/s0960-894x(02)00751-5 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44293378 | 101423 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 618 | 13 | 1 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)CC(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
CHEMBL300792 | 101423 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 618 | 13 | 1 | 3 | 8.8 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(CCCCc2ccncc2)CC(C)C)c1 | 10.1016/s0960-894x(01)00275-x | ||
1185 | 3645 | 32 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44561368 | 176240 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL460892 | 176240 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 480 | 4 | 3 | 4 | 5.0 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cccc6[nH]c(=O)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
67144496 | 169267 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cncs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4439817 | 169267 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cncs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44274248 | 98220 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2Cl)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL277435 | 98220 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 643 | 9 | 0 | 7 | 7.5 | COc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2Cl)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
67143514 | 172829 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 3.6 | Cc1c(N2CCCC(C)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4528231 | 172829 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 3.6 | Cc1c(N2CCCC(C)C2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
44593415 | 188790 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1021/jm701249f | ||
CHEMBL512893 | 188790 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 5 | 3 | 5 | 4.3 | FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5[nH]c(=S)[nH]c45)CC3)cccc2[nH]1 | 10.1021/jm701249f | ||
10930638 | 98572 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL280212 | 98572 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 698 | 10 | 1 | 7 | 8.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)c3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44417615 | 141391 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL387006 | 141391 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 662 | 9 | 2 | 9 | 6.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
10674894 | 25336 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL135103 | 25336 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 588 | 10 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm9803673 | ||
CHEMBL261927 | 208776 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1ccccn1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
15602807 | 8136 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092245 | 8136 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 476 | 4 | 0 | 6 | 5.6 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
44391628 | 65541 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 10 | 1 | 7 | 4.4 | CCOC(=O)CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL183572 | 65541 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 10 | 1 | 7 | 4.4 | CCOC(=O)CSc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
44391542 | 64896 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL182639 | 64896 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
44573753 | 186888 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL494021 | 186888 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 442 | 4 | 1 | 5 | 4.9 | Cc1cc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)nn1C | 10.1016/j.bmcl.2009.02.043 | ||
44391735 | 121823 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 591 | 10 | 3 | 5 | 5.7 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1Cl | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL359914 | 121823 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 591 | 10 | 3 | 5 | 5.7 | O=C(NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1)Nc1ccccc1Cl | 10.1016/j.bmcl.2004.10.090 | ||
44391771 | 165469 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.7 | CC(C)(C)NC(=O)NCCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL425524 | 165469 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 10 | 3 | 5 | 4.7 | CC(C)(C)NC(=O)NCCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
86275343 | 182909 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 655 | 6 | 1 | 6 | 4.7 | O=C(NCc1ncc(C(F)(F)F)cc1F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4799511 | 182909 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 655 | 6 | 1 | 6 | 4.7 | O=C(NCc1ncc(C(F)(F)F)cc1F)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
44391835 | 165751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.8 | CC(C)(C)CC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
CHEMBL427146 | 165751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 536 | 10 | 2 | 5 | 4.8 | CC(C)(C)CC(=O)NCCc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.090 | ||
15895696 | 111972 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
CHEMBL329834 | 111972 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 6 | 1 | 6 | 6.0 | Cc1cc(C)cc(-c2c(O)nc3cc(Cl)c([N+](=O)[O-])cc3c2OCC[C@H]2CCCCN2C)c1 | 10.1016/s0960-894x(99)00447-3 | ||
44573585 | 186657 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 429 | 4 | 1 | 5 | 5.1 | Cc1ncoc1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492587 | 186657 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 429 | 4 | 1 | 5 | 5.1 | Cc1ncoc1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
67143612 | 170483 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 638 | 9 | 2 | 8 | 3.6 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4456937 | 170483 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 638 | 9 | 2 | 8 | 3.6 | Cc1c(N2CCN(Cc3cccc(C(N)=O)c3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
44359289 | 12045 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1184180 | 12045 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL337323 | 12045 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 6.3 | CCn1nccc1NC(=O)c1cc2c(OCCC3CCCCN3)c(-c3cc(C)cc(C)c3)c(O)nc2cc1Cl | 10.1016/s0960-894x(00)00024-x | ||
44402616 | 70792 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 469 | 7 | 2 | 7 | 5.5 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C1CC1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195516 | 70792 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 469 | 7 | 2 | 7 | 5.5 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)NC(C)(C)C)ccc2n1C1CC1 | 10.1016/j.bmcl.2005.03.030 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/acs.jmedchem.6b01071 | ||
118179135 | 181436 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4780737 | 181436 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
44572286 | 180219 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
CHEMBL475650 | 180219 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 494 | 4 | 3 | 5 | 5.2 | CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5ccc6c(c5)NCC(=O)N6)CC4)cccc3[nH]2)cc1 | 10.1021/jm801572m | ||
44406776 | 133819 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL2370262 | 208078 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccccn1)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990433g | ||||
44444675 | 154184 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL399857 | 154184 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 630 | 7 | 1 | 5 | 6.3 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(C(=O)N3CCOCC3)C(C)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44402038 | 69864 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 472 | 7 | 1 | 8 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)OC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL194074 | 69864 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 472 | 7 | 1 | 8 | 6.2 | COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(NC(=O)OC(C)(C)C)ccc2n1C(C)C | 10.1016/j.bmcl.2005.03.030 | ||
44402673 | 132747 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 499 | 10 | 2 | 7 | 6.4 | CCCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL370414 | 132747 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 499 | 10 | 2 | 7 | 6.4 | CCCCCn1c(SCc2cc([N+](=O)[O-])ccc2OC)nc2cc(NC(=O)NC(C)(C)C)ccc21 | 10.1016/j.bmcl.2005.03.030 | ||
44391670 | 64361 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.8 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL181864 | 64361 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.8 | CCOc1nc2cc(S(=O)(=O)NCc3ccc(F)cc3)ccc2n1Cc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.10.089 | ||
67143618 | 169727 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 637 | 8 | 1 | 10 | 4.1 | Cc1c(N2CCN(Cc3cccc4nonc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4446435 | 169727 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 637 | 8 | 1 | 10 | 4.1 | Cc1c(N2CCN(Cc3cccc4nonc34)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
67143023 | 174425 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 656 | 9 | 2 | 10 | 4.2 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4566719 | 174425 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 656 | 9 | 2 | 10 | 4.2 | Cc1c(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(=O)n(C[C@H](N)c2ccccc2O)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
155531714 | 175617 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4593521 | 175617 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 715 | 13 | 2 | 9 | 5.2 | COc1cccc(N2CCN(c3c(C)n(Cc4c(F)cccc4C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c4ccccc4)c3=O)CC2)c1F | 10.1021/acs.jmedchem.6b01071 | ||
145949399 | 162184 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 577 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccc(C(F)(F)F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
CHEMBL4171288 | 162184 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 577 | 8 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)Cc3cccc(C(F)(F)F)c3)c2=O)c1F | 10.1016/j.ejmech.2017.12.095 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm060580w | ||
44359254 | 11527 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL1180716 | 11527 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
CHEMBL139292 | 11527 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 561 | 8 | 3 | 8 | 5.8 | COc1nccc(NC(=O)c2cc3c(OCCC4CCCCN4)c(-c4cc(C)cc(C)c4)c(O)nc3cc2Cl)n1 | 10.1016/s0960-894x(00)00024-x | ||
11549071 | 138417 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 628 | 11 | 2 | 7 | 6.4 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CN)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
CHEMBL378481 | 138417 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 628 | 11 | 2 | 7 | 6.4 | CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(NC(=O)CN)cc3)c(CN(C)Cc3ccccc3)c2c1=O | 10.1021/jm0512894 | ||
10985312 | 78336 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
CHEMBL21126 | 78336 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1021/jm020180i | ||
70691201 | 77300 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1952 | 47 | 22 | 28 | -0.7 | CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CO/N=C(\C)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2012.08.014 | ||
CHEMBL2088506 | 77300 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1952 | 47 | 22 | 28 | -0.7 | CCCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CO/N=C(\C)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1016/j.ejmech.2012.08.014 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44348333 | 96445 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)N(C)C(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL265727 | 96445 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1575 | 40 | 14 | 17 | 2.9 | CC(=O)Nc1ccc(C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](NC(C)=O)N(C)C(=O)c2ccc3ccccc3c2)C(=O)N[C@H](Cc2ccc(NC(C)=O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)cc1 | 10.1021/jm970024p | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
44406776 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL371722 | 133819 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 609 | 14 | 2 | 3 | 8.8 | COc1c(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2[C@H](C)CNCCc2ccccc2)cc1C | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL3085508 | 209243 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1NCCC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm0506928 | ||||
15602806 | 8212 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1092638 | 8212 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 456 | 5 | 1 | 5 | 5.2 | CCc1nc(CN2CCN(c3cccn4cc(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c(C)[nH]1 | 10.1016/j.bmcl.2010.02.099 | ||
71623059 | 180243 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4756920 | 180243 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 603 | 6 | 1 | 6 | 4.2 | O=C(NCc1ncccc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
118179135 | 181436 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4780737 | 181436 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 569 | 5 | 1 | 4 | 4.9 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NCc3ccccc3Cl)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C | 10.1021/acs.jmedchem.0c01076 | ||
44573585 | 186657 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 429 | 4 | 1 | 5 | 5.1 | Cc1ncoc1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492587 | 186657 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 429 | 4 | 1 | 5 | 5.1 | Cc1ncoc1CN1CCN(c2cccc3[nH]c(-c4ccc(C(C)(C)C)cc4)nc23)CC1 | 10.1016/j.bmcl.2009.02.043 | ||
44267240 | 9604 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 427 | 10 | 2 | 3 | 6.0 | COc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cn1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11310 | 9604 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 427 | 10 | 2 | 3 | 6.0 | COc1ccc(CCCCNCCc2c(-c3cc(C)cc(C)c3)[nH]c3ccccc23)cn1 | 10.1016/s0960-894x(01)00133-0 | ||
44365088 | 120981 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 10 | 3 | 2 | 6.3 | CCc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL358260 | 120981 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 10 | 3 | 2 | 6.3 | CCc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44365500 | 164731 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1C | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL423215 | 164731 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 9 | 3 | 2 | 6.3 | Cc1cccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)c1C | 10.1016/s0960-894x(00)00707-1 | ||
44417614 | 141086 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL385175 | 141086 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 727 | 11 | 2 | 7 | 8.2 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCc3ccccc3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44365374 | 41414 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL149196 | 41414 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 398 | 9 | 3 | 2 | 6.0 | Cc1ccc(-c2[nH]c3ccccc3c2CCNCCCCc2ccc(O)cc2)cc1 | 10.1016/s0960-894x(00)00707-1 | ||
44365249 | 120563 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 370 | 6 | 3 | 2 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
CHEMBL357025 | 120563 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 370 | 6 | 3 | 2 | 5.5 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2ccc(O)cc2)c1 | 10.1016/s0960-894x(00)00707-1 | ||
44322272 | 204458 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 382 | 4 | 1 | 4 | 5.1 | CN1CCCCC1COc1c(-c2ccccc2)c(O)nc2cc(Cl)ccc12 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL86365 | 204458 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 382 | 4 | 1 | 4 | 5.1 | CN1CCCCC1COc1c(-c2ccccc2)c(O)nc2cc(Cl)ccc12 | 10.1016/s0960-894x(99)00446-1 | ||
44322052 | 204969 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 356 | 6 | 1 | 4 | 4.6 | CN(C)CCCOc1c(-c2ccccc2)c(O)nc2cc(Cl)ccc12 | 10.1016/s0960-894x(99)00446-1 | ||
CHEMBL89675 | 204969 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 356 | 6 | 1 | 4 | 4.6 | CN(C)CCCOc1c(-c2ccccc2)c(O)nc2cc(Cl)ccc12 | 10.1016/s0960-894x(99)00446-1 | ||
44267257 | 9273 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 355 | 6 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
CHEMBL11134 | 9273 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 355 | 6 | 2 | 2 | 5.2 | Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCNCc2ccncc2)c1 | 10.1016/s0960-894x(01)00133-0 | ||
118178989 | 180572 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccc(Cl)cc4)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4760799 | 180572 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 621 | 6 | 1 | 4 | 5.8 | CC(=O)N1CCC2(CC1)c1cc(C(=O)NC3(c4ccc(Cl)cc4)CC3)ccc1N(S(=O)(=O)c1ccc(F)cc1)C2C1CC1 | 10.1021/acs.jmedchem.0c01076 | ||
71666685 | 182132 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 6 | 1 | 6 | 3.6 | O=C(NCc1ccccn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4789613 | 182132 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 6 | 1 | 6 | 3.6 | O=C(NCc1ccccn1)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(F)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
67144496 | 169267 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cncs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
CHEMBL4439817 | 169267 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 602 | 8 | 1 | 9 | 4.0 | Cc1c(N2CCN(Cc3cncs3)CC2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.6b01071 | ||
86275573 | 115689 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 687 | 6 | 1 | 6 | 5.8 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/ml5004469 | ||
CHEMBL3358416 | 115689 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 687 | 6 | 1 | 6 | 5.8 | O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1ccc2c(c1)C1(CCS(=O)(=O)CC1)C(C1CC1)N2S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/ml5004469 | ||
44444663 | 93766 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL249771 | 93766 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 645 | 8 | 2 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN2CCC(CNC(=O)N3CCOCC3)CC2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
1185 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1021/jm0506928 | ||
44391525 | 165813 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(OC)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL427500 | 165813 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 467 | 9 | 1 | 6 | 4.7 | CCSc1nc2cc(S(=O)(=O)NCc3ccc(OC)cc3)ccc2n1Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
15602804 | 7998 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
CHEMBL1091209 | 7998 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 458 | 4 | 2 | 6 | 3.0 | CC(C)(C)c1ccc(-c2cn3cccc(N4CCN(Cc5c[nH]c(=O)[nH]c5=O)CC4)c3n2)cc1 | 10.1016/j.bmcl.2010.02.099 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1021/jm060580w | ||
44561108 | 185848 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL487627 | 185848 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 468 | 3 | 2 | 4 | 4.8 | FC(F)(F)c1nc2c(N3CCN(Cc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL436874 | 211941 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0506928 | ||||
44444630 | 154285 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
CHEMBL400390 | 154285 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 596 | 7 | 2 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3sc(C(C)(C)C(=O)N4CCCC4)cc3c2[C@H](C)CNC(=O)N2CCC(c3ccccc3)C2)c1 | 10.1016/j.bmcl.2007.09.099 | ||
44391542 | 64896 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
CHEMBL182639 | 64896 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 518 | 9 | 1 | 6 | 5.4 | O=S(=O)(NCc1ccc(F)cc1)c1ccc2c(c1)nc(SCc1ccccn1)n2Cc1ccccc1 | 10.1016/j.bmcl.2004.10.089 | ||
11626096 | 186687 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 428 | 4 | 1 | 5 | 4.6 | Cn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1 | 10.1016/j.bmcl.2009.02.043 | ||
CHEMBL492780 | 186687 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 428 | 4 | 1 | 5 | 4.6 | Cn1cnc(CN2CCN(c3cccc4[nH]c(-c5ccc(C(C)(C)C)cc5)nc34)CC2)c1 | 10.1016/j.bmcl.2009.02.043 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm0506928 | ||
44402648 | 70953 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 8 | 1 | 7 | 5.1 | COC(=O)c1ccc(OC)c(CSc2nc3cc(NC(=O)C4CC4)ccc3n2C(C)C)c1 | 10.1016/j.bmcl.2005.03.030 | ||
CHEMBL195726 | 70953 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 8 | 1 | 7 | 5.1 | COC(=O)c1ccc(OC)c(CSc2nc3cc(NC(=O)C4CC4)ccc3n2C(C)C)c1 | 10.1016/j.bmcl.2005.03.030 | ||
118167818 | 178852 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4740373 | 178852 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 527 | 5 | 2 | 4 | 4.6 | CC1N(S(=O)(=O)c2ccc(F)cc2)c2ccc(C(=O)NCc3ccccc3Cl)cc2C12CCNCC2 | 10.1021/acs.jmedchem.0c01076 | ||
118179051 | 179638 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4749790 | 179638 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 581 | 6 | 1 | 5 | 4.8 | COc1ccc(S(=O)(=O)N2c3ccc(C(=O)NCc4ccccc4Cl)cc3C3(CCN(C(C)=O)CC3)C2C)cc1 | 10.1021/acs.jmedchem.0c01076 | ||
25193797 | 189073 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL515200 | 189073 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 548 | 7 | 2 | 5 | 6.4 | CC(C)c1ccc(-c2nc3c(N4CCN(CCOc5cccc6nc(C(F)(F)F)[nH]c56)CC4)cccc3[nH]2)cc1 | 10.1016/j.bmc.2008.05.024 | ||
CHEMBL414113 | 211362 | 0 | None | - | 1 | Rat | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
101609491 | 141284 | 0 | None | - | 1 | Rat | 10.0 | pKd | = | 10.0 | Binding | ChEMBL | 1555 | 45 | 18 | 19 | -1.1 | CCCC/N=C(/NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)NC(N)=O | 10.1021/jm00112a013 | ||
44317046 | 141284 | 0 | None | - | 1 | Rat | 10.0 | pKd | = | 10.0 | Binding | ChEMBL | 1555 | 45 | 18 | 19 | -1.1 | CCCC/N=C(/NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)NC(N)=O | 10.1021/jm00112a013 | ||
77058850 | 141284 | 0 | None | - | 1 | Rat | 10.0 | pKd | = | 10.0 | Binding | ChEMBL | 1555 | 45 | 18 | 19 | -1.1 | CCCC/N=C(/NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)NC(N)=O | 10.1021/jm00112a013 | ||
CHEMBL386314 | 141284 | 0 | None | - | 1 | Rat | 10.0 | pKd | = | 10.0 | Binding | ChEMBL | 1555 | 45 | 18 | 19 | -1.1 | CCCC/N=C(/NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O)NC(N)=O | 10.1021/jm00112a013 | ||
1190 | 869 | 41 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c01076 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c01076 | ||||
583 | 869 | 41 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c01076 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c01076 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c01076 | ||||
CHEMBL2369860 | 207967 | 0 | None | - | 1 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL2370807 | 208178 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00101a003 | ||||
3823 | 49951 | 38 | None | -1 | 11 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
76973198 | 49951 | 38 | None | -1 | 11 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL157101 | 49951 | 38 | None | -1 | 11 | Rat | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL414391 | 211382 | 0 | None | - | 1 | Rat | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | C/N=C(\NC#N)NCCCC[C@@H](NC(=O)[C@H](CCCCN/C(=N\C)NC#N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL407225 | 210902 | 0 | None | - | 1 | Rat | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O)c1cccnc1)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL266716 | 208949 | 0 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00101a003 | ||||
CHEMBL218396 | 207650 | 0 | None | - | 1 | Rat | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL269583 | 209053 | 0 | None | - | 1 | Rat | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCC/N=C(\NC#N)NCc1ccccn1)NC(=O)[C@H](CCCC/N=C(\NC#N)NCc1ccccn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL376017 | 210493 | 0 | None | - | 1 | Rat | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N1CC=C[C@H]1C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O | 10.1021/jm00398a030 | ||||
CHEMBL438762 | 212047 | 0 | None | - | 1 | Rat | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCC/N=C(/NC#N)NC(C)C)NC(=O)[C@H](CCCC/N=C(/NC#N)NC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL2370809 | 208180 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCNC(=O)c1cccnc1)C(=O)N[C@@H](CCCCNC(=O)c1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00101a003 | ||||
10348973 | 3261 | 50 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
5432 | 3261 | 50 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
5586 | 3261 | 50 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
DB11853 | 3261 | 50 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
3823 | 49951 | 38 | None | -1 | 11 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
76973198 | 49951 | 38 | None | -1 | 11 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL157101 | 49951 | 38 | None | -1 | 11 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL261999 | 208780 | 0 | None | - | 1 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCC/N=C(\NC#N)NCc1ccccn1)NC(=O)[C@H](CCC/N=C(\NC#N)NCc1ccccn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
44316759 | 168302 | 0 | None | - | 1 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 1537 | 45 | 17 | 19 | -0.7 | CCCC/N=C(\NC#N)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||
CHEMBL438191 | 168302 | 0 | None | - | 1 | Rat | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 1537 | 45 | 17 | 19 | -0.7 | CCCC/N=C(\NC#N)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CCCCNC(=O)c1cccnc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||
CHEMBL2369851 | 207966 | 0 | None | - | 1 | Rat | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL2370818 | 208182 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CCCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00101a003 | ||||
CHEMBL441741 | 212145 | 0 | None | - | 1 | Rat | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | 10.1021/jm00398a030 | ||||
CHEMBL2370808 | 208179 | 0 | None | - | 1 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00101a003 | ||||
CHEMBL439892 | 212104 | 0 | None | - | 1 | Rat | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CSSC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
10348973 | 3261 | 50 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
5432 | 3261 | 50 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
5586 | 3261 | 50 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL1800159 | 3261 | 50 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
DB11853 | 3261 | 50 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 623 | 9 | 2 | 11 | 3.8 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(C)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccc(nn1)OC | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL2370803 | 208177 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CCCCNc1n[nH]c(N)n1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O | 10.1021/jm00101a003 | ||||
CHEMBL2370814 | 208181 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | None | None | None | CCNC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CCCCNc1n[nH]c(N)n1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(C)=O | 10.1021/jm00101a003 | ||||
CHEMBL407482 | 210917 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9 | Binding | ChEMBL | None | None | None | CCCC/N=C(\NC#N)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc1cccnc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL411806 | 211212 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9 | Binding | ChEMBL | None | None | None | CC(=O)NC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(C)=O)c1cccnc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(N)=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL436334 | 211931 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CCC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL2371272 | 208283 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](N)Cc2ccc3ccccc3c2)CCC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm00398a030 | ||||
CHEMBL414149 | 211366 | 0 | None | - | 1 | Rat | 9.0 | pKd | = | 9.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
11250647 | 1516 | 40 | None | 117 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
5293 | 1516 | 40 | None | 117 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
8362 | 1516 | 40 | None | 117 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL1208155 | 1516 | 40 | None | 117 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
DB11979 | 1516 | 40 | None | 117 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL407023 | 210885 | 0 | None | - | 1 | Rat | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | None | None | None | CCCC/N=C(\NC#N)NCCCC[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL439359 | 212091 | 0 | None | - | 1 | Rat | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](CCCC/N=C(\NC#N)NC1CCCCC1)NC(=O)[C@H](CCCC/N=C(\NC#N)NC1CCCCC1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL411586 | 211199 | 0 | None | - | 1 | Rat | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | None | None | None | CCCC/N=C(\NC#N)NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCCN/C(=N/CCCC)NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL412802 | 211279 | 0 | None | - | 1 | Rat | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | None | None | None | CCCC/N=C(\NC#N)NCCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cccnc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL2371274 | 208285 | 0 | None | - | 1 | Rat | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](N)Cc2ccc3ccccc3c2)CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm00398a030 | ||||
CHEMBL2371275 | 208286 | 0 | None | - | 1 | Rat | 8.0 | pKd | = | 8 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](N)Cc2ccc3ccccc3c2)CNC(=O)C[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm00398a030 | ||||
CHEMBL442303 | 212161 | 0 | None | - | 1 | Rat | 8.0 | pKd | = | 8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CNC(=O)C[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL265825 | 208920 | 0 | None | - | 1 | Rat | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CC(=O)NCCC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL428837 | 211731 | 0 | None | - | 1 | Rat | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | None | None | None | CCCC/N=C(\NC#N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCN/C(=N/CCCC)NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
11250647 | 1516 | 40 | None | 117 | 2 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
5293 | 1516 | 40 | None | 117 | 2 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
8362 | 1516 | 40 | None | 117 | 2 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL1208155 | 1516 | 40 | None | 117 | 2 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
DB11979 | 1516 | 40 | None | 117 | 2 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL265522 | 208907 | 0 | None | - | 1 | Rat | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | None | None | None | CCCCCC/N=C(\NC#N)NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](CCCCN/C(=N/CCCCCC)NC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O | 10.1021/jm00112a013 | ||||
CHEMBL442303 | 212161 | 0 | None | - | 1 | Rat | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C(=O)N[C@H]1CNC(=O)C[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](c2cccnc2)NC(=O)[C@H](CCCN=C(N)N)NC1=O)c1cccnc1 | 10.1021/jm00398a030 | ||||
CHEMBL2371273 | 208284 | 0 | None | - | 1 | Rat | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](N)Cc2ccc3ccccc3c2)CC(=O)NCCC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm00398a030 | ||||
12784 | 571 | 8 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
85469632 | 571 | 8 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL2371277 | 208288 | 0 | None | - | 1 | Rat | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@H](N)Cc2ccc3ccccc3c2)CSSC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm00398a030 | ||||
3823 | 49951 | 38 | None | -1 | 11 | Rat | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
76973198 | 49951 | 38 | None | -1 | 11 | Rat | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
CHEMBL157101 | 49951 | 38 | None | -1 | 11 | Rat | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | 10.1021/jm00129a003 | ||
12784 | 571 | 8 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
85469632 | 571 | 8 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL4537788 | 571 | 8 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 671 | 6 | 1 | 6 | 5.3 | ClC1=C(CNC(C2=CC=C3N(S(=O)(C4=CC=C(F)C=C4)=O)[C@@H](C5CC5)C6(CCS(CC6)(=O)=O)C3=C2)=O)N=CC(C(F)(F)F)=C1 | 10.1021/acs.jmedchem.0c01076 | ||
CHEMBL409219 | 211007 | 0 | None | - | 1 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||||
CHEMBL268397 | 209006 | 0 | None | - | 1 | Rat | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1csc2ccccc12)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||||
44383749 | 96220 | 0 | None | - | 1 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 1534 | 41 | 13 | 18 | 3.1 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCC(N)C(=O)c1ccncc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||
CHEMBL263839 | 96220 | 0 | None | - | 1 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 1534 | 41 | 13 | 18 | 3.1 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCC(N)C(=O)c1ccncc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||
CHEMBL263840 | 208846 | 0 | None | - | 1 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1csc2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||||
CHEMBL268319 | 209000 | 0 | None | - | 1 | Rat | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | None | None | None | COc1ccc(C(=O)CC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)cc1 | 10.1021/jm00059a020 | ||||
44383968 | 158776 | 0 | None | - | 1 | Rat | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 1590 | 45 | 14 | 20 | 2.5 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCC(N)C(=O)c1cccnc1)C(=O)N[C@@H](CCCC(N)C(=O)c1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||
CHEMBL409990 | 158776 | 0 | None | - | 1 | Rat | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 1590 | 45 | 14 | 20 | 2.5 | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCC(N)C(=O)c1cccnc1)C(=O)N[C@@H](CCCC(N)C(=O)c1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC(N)C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||
CHEMBL2371478 | 208306 | 0 | None | - | 1 | Rat | 10.0 | pKi | = | 10 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](Cc3c[nH]cn3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44267907 | 16155 | 0 | None | 3 | 3 | Rat | 10.0 | pKi | = | 10.0 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12282 | 16155 | 0 | None | 3 | 3 | Rat | 10.0 | pKi | = | 10.0 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL438829 | 212053 | 0 | None | - | 1 | Rat | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O | 10.1021/jm00059a020 | ||||
CHEMBL2371592 | 208357 | 0 | None | - | 1 | Rat | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCNC(=O)CNC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990116+ | ||||
CHEMBL386166 | 210630 | 0 | None | - | 1 | Rat | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL405548 | 210818 | 0 | None | - | 1 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCNC(=O)CNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990118u | ||||
CHEMBL2371557 | 208338 | 0 | None | - | 1 | Rat | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)NCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44379996 | 96392 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CC(=O)NCCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
91931282 | 96392 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CC(=O)NCCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
CHEMBL265240 | 96392 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CC(=O)NCCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
44378966 | 95997 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 1336 | 26 | 15 | 17 | -3.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCC(=O)NC(=O)CC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
CHEMBL262160 | 95997 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 1336 | 26 | 15 | 17 | -3.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCC(=O)NC(=O)CC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
CHEMBL2371516 | 208322 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)CNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL2371582 | 208350 | 0 | None | - | 1 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)NCCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371533 | 208329 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)NCCCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
11364940 | 177950 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 555 | 8 | 1 | 8 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL466731 | 177950 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 555 | 8 | 1 | 8 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
1185 | 3645 | 32 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL2371483 | 208308 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL2371485 | 208310 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](CCCN=C(N)N)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL2371515 | 208321 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)CN(C)C(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
23656390 | 161134 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL413245 | 161134 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 659 | 10 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
1184 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
9874838 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
CHEMBL71917 | 3676 | 31 | None | 426 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1039/C7MD00320J | ||
CHEMBL407361 | 210910 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)N[C@H](C)C(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL439083 | 212071 | 0 | None | - | 1 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL2371514 | 208320 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL2371522 | 208326 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](Cc3ccc(Cl)cc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44267812 | 97652 | 0 | None | 7 | 3 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 941 | 10 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273440 | 97652 | 0 | None | 7 | 3 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 941 | 10 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL438897 | 212056 | 0 | None | -1 | 2 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL438897 | 212056 | 0 | None | 1 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990118u | ||||
CHEMBL436657 | 211936 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CSSC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL406809 | 210873 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCCCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL2371591 | 208356 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N1CC=C[C@H]1C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL269726 | 209059 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N1CC=C[C@@H]1C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm990118u | ||||
CHEMBL2371507 | 208317 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCNC(=O)[C@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44379287 | 160869 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1299 | 26 | 14 | 15 | -1.6 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
CHEMBL412681 | 160869 | 0 | None | - | 1 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1299 | 26 | 14 | 15 | -1.6 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
44449120 | 94789 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL256109 | 94789 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
44432648 | 149694 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL395225 | 149694 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 643 | 9 | 2 | 4 | 7.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4nccnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL411964 | 211218 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL2371537 | 208330 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCCC1C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)CC[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
CHEMBL2371587 | 208354 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990116+ | ||||
CHEMBL441208 | 212138 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990118u | ||||
CHEMBL2371566 | 208343 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCCC1C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)CCNC(=O)C[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
44378889 | 168591 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 1251 | 27 | 13 | 16 | -2.8 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||
CHEMBL440436 | 168591 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 1251 | 27 | 13 | 16 | -2.8 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||
CHEMBL2371519 | 208325 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44267907 | 16155 | 0 | None | -3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL12282 | 16155 | 0 | None | -3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44267907 | 16155 | 0 | None | -3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12282 | 16155 | 0 | None | -3 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 937 | 11 | 1 | 14 | 6.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL2371568 | 208344 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)NCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371578 | 208347 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)NCCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371517 | 208323 | 0 | None | - | 1 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)CNC(=O)C[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44448991 | 154802 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL2371470 | 208305 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||||
CHEMBL2371486 | 208311 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)CCNC(=O)C[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL410779 | 211092 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
9872676 | 77826 | 0 | None | 1 | 17 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
CHEMBL210514 | 77826 | 0 | None | 1 | 17 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
9872676 | 77826 | 0 | None | -1 | 17 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
CHEMBL210514 | 77826 | 0 | None | -1 | 17 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 565 | 11 | 2 | 10 | 4.8 | COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1021/jm060012g | ||
10649568 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL120432 | 14397 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/s0960-894x(03)00746-7 | ||
9961721 | 167914 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL435167 | 167914 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 665 | 10 | 2 | 7 | 7.0 | CCNC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
44432647 | 86313 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 622 | 9 | 2 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(=O)n(C)c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231954 | 86313 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 622 | 9 | 2 | 4 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(=O)n(C)c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL216634 | 207590 | 0 | None | - | 1 | Rat | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11376252 | 69028 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 547 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1021/jm701249f | ||
CHEMBL192955 | 69028 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 547 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1021/jm701249f | ||
11376252 | 69028 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 547 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL192955 | 69028 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 547 | 7 | 1 | 6 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL2371577 | 208346 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL429007 | 211744 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11421412 | 178164 | 11 | None | 2398 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL468551 | 178164 | 11 | None | 2398 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44388510 | 165687 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 538 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccn3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL426780 | 165687 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 538 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccn3)c2=O)c1F | 10.1021/jm049218c | ||
11421412 | 178164 | 11 | None | 2398 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL468551 | 178164 | 11 | None | 2398 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
44432651 | 86276 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231760 | 86276 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 632 | 9 | 3 | 4 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44432643 | 146234 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392446 | 146234 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 592 | 9 | 2 | 3 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2008.04.029 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2008.04.029 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2008.04.029 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2005.03.057 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2005.03.057 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1016/j.bmcl.2005.03.057 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
CHEMBL2371579 | 208348 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CCCCC1C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)[C@@H](C)NC(=O)C[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
CHEMBL2371508 | 208318 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](CCCN=C(N)N)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
11443711 | 10037 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 515 | 8 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C3CCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL115703 | 10037 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 515 | 8 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C3CCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44346397 | 114000 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL333518 | 114000 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 639 | 10 | 0 | 9 | 6.2 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44432652 | 96693 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL267838 | 96693 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 633 | 9 | 3 | 5 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cnc4[nH]nnc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44432654 | 159248 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL410547 | 159248 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 660 | 10 | 3 | 6 | 6.1 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(-c4nnn[nH]4)nc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44400235 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL434936 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.07.059 | ||
10345138 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL360143 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL75347 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
44449681 | 95599 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL259906 | 95599 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
9854500 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL303274 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/s0960-894x(02)00370-0 | ||
9854500 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm701249f | ||
CHEMBL303274 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm701249f | ||
44400235 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL434936 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44400235 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL434936 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
44400235 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL434936 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44400235 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL434936 | 167867 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
9854500 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL303274 | 101802 | 0 | None | 1 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44267887 | 98029 | 0 | None | -5 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 967 | 10 | 1 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275935 | 98029 | 0 | None | -5 | 3 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 967 | 10 | 1 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
10345138 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm701249f | ||
CHEMBL360143 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm701249f | ||
CHEMBL75347 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm701249f | ||
44448991 | 154802 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
10345138 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL360143 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL75347 | 122042 | 0 | None | 2041 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL2371541 | 208333 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CCCCC1C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)CNC(=O)C[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
44432653 | 86277 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231761 | 86277 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 650 | 9 | 3 | 4 | 6.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2cc4nn[nH]c4cc2F)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44451355 | 157621 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 577 | 11 | 2 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(C)CNCCCCc2ccnnc2)c1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL408746 | 157621 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 577 | 11 | 2 | 4 | 7.4 | Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2C(C)CNCCCCc2ccnnc2)c1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL2371502 | 208316 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@](C)(Cc2ccc(O)cc2)NC1=O | 10.1021/jm990115h | ||||
CHEMBL2371484 | 208309 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCNC(=O)[C@H](Cc3ccccc3)NC(=O)C[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44380258 | 160710 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CCC(=O)NCCC(=O)NC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
91931283 | 160710 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CCC(=O)NCCC(=O)NC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
CHEMBL411963 | 160710 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 1441 | 14 | 16 | 15 | -2.1 | CC(=O)N[C@@H]1CCC(=O)NCCC(=O)NC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||
10985312 | 78336 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL21126 | 78336 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
10985312 | 78336 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL21126 | 78336 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 650 | 10 | 1 | 7 | 7.2 | CCC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL2371575 | 208345 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL405420 | 210812 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
44288080 | 159641 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 1009 | 15 | 2 | 14 | 7.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(CC3CC3)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL410940 | 159641 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 1009 | 15 | 2 | 14 | 7.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(CC3CC3)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(F)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL407800 | 210937 | 0 | None | - | 1 | Rat | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44400245 | 125560 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 541 | 8 | 1 | 8 | 3.1 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL364914 | 125560 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 541 | 8 | 1 | 8 | 3.1 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
44400245 | 125560 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 541 | 8 | 1 | 8 | 3.1 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL364914 | 125560 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 541 | 8 | 1 | 8 | 3.1 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
11250647 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
5293 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
8362 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
CHEMBL1208155 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
DB11979 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
44400271 | 68986 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL192912 | 68986 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL2371549 | 208335 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CN)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC1=O | 10.1021/jm990115h | ||||
44432649 | 86272 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 645 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]c(C)nc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL231739 | 86272 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 645 | 9 | 3 | 3 | 7.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc4[nH]c(C)nc4c2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11365653 | 173618 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL454774 | 173618 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
10311600 | 160361 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 523 | 10 | 3 | 9 | 4.4 | CNCCNc1nc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)OC4(C)C)o2)c(OC)n1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL411526 | 160361 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 523 | 10 | 3 | 9 | 4.4 | CNCCNc1nc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)OC4(C)C)o2)c(OC)n1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL385982 | 210625 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NCCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL410357 | 211068 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)NCCCC[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@@H]3CCCN3C2=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11477988 | 90579 | 0 | None | 954 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL23969 | 90579 | 0 | None | 954 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm701249f | ||
11477988 | 90579 | 0 | None | 954 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23969 | 90579 | 0 | None | 954 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
21018389 | 67123 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 517 | 6 | 1 | 5 | 5.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL189164 | 67123 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 517 | 6 | 1 | 5 | 5.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44353277 | 20070 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 712 | 16 | 2 | 7 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCCc4ccccc4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130558 | 20070 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 712 | 16 | 2 | 7 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCCc4ccccc4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
25156943 | 187853 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 597 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL502341 | 187853 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 597 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
21036877 | 173078 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL453441 | 173078 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44340749 | 108631 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL321376 | 108631 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
44267868 | 97624 | 0 | None | 10 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273275 | 97624 | 0 | None | 10 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
9809065 | 101160 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1 | 10.1021/jm0205402 | ||
CHEMBL298982 | 101160 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccn1 | 10.1021/jm0205402 | ||
11202636 | 10135 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 489 | 9 | 1 | 6 | 4.1 | CN[C@H](CC(C)C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
CHEMBL116071 | 10135 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 489 | 9 | 1 | 6 | 4.1 | CN[C@H](CC(C)C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
44353248 | 19552 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 623 | 13 | 1 | 8 | 5.9 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130126 | 19552 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 623 | 13 | 1 | 8 | 5.9 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
11202636 | 10135 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 489 | 9 | 1 | 6 | 4.1 | CN[C@H](CC(C)C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
CHEMBL116071 | 10135 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 489 | 9 | 1 | 6 | 4.1 | CN[C@H](CC(C)C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
21018389 | 67123 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 517 | 6 | 1 | 5 | 5.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL189164 | 67123 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 517 | 6 | 1 | 5 | 5.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
44379167 | 167199 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1376 | 16 | 15 | 15 | -1.0 | CC(=O)NC1CC(=O)NC(C(=O)N[C@H]2CC(=O)NC(C(=O)O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)C(Cc3ccc4ccccc4c3)NC(=O)[C@H](Cc3ccc(O)cc3)NC2=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||
CHEMBL430344 | 167199 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1376 | 16 | 15 | 15 | -1.0 | CC(=O)NC1CC(=O)NC(C(=O)N[C@H]2CC(=O)NC(C(=O)O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)C(Cc3ccc4ccccc4c3)NC(=O)[C@H](Cc3ccc(O)cc3)NC2=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||
CHEMBL2371487 | 208312 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
11331001 | 188435 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
21036878 | 172477 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 5.9 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL451916 | 172477 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 5.9 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
11365653 | 173618 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL454774 | 173618 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.7 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
11331001 | 188435 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.07.059 | ||
11262242 | 188152 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL505033 | 188152 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44288081 | 157779 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 993 | 13 | 1 | 14 | 8.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(CC3CC3)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL408925 | 157779 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 993 | 13 | 1 | 14 | 8.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(CC3CC3)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44400261 | 133491 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 527 | 7 | 1 | 7 | 3.6 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL371613 | 133491 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 527 | 7 | 1 | 7 | 3.6 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2008.04.036 | ||
44400261 | 133491 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 527 | 7 | 1 | 7 | 3.6 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL371613 | 133491 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 527 | 7 | 1 | 7 | 3.6 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2005.03.057 | ||
44378649 | 96706 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1287 | 27 | 14 | 15 | -1.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||
CHEMBL267984 | 96706 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1287 | 27 | 14 | 15 | -1.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCC(=O)N(CC(N)=O)C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||
44379259 | 141072 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1277 | 24 | 12 | 15 | -0.4 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2cccnc2)NC1=O | 10.1021/jm990115h | ||
CHEMBL385090 | 141072 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1277 | 24 | 12 | 15 | -0.4 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2cccnc2)NC1=O | 10.1021/jm990115h | ||
44378908 | 161283 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1273 | 27 | 14 | 15 | -2.3 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)N(CC(=O)O)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm990115h | ||
CHEMBL414556 | 161283 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 1273 | 27 | 14 | 15 | -2.3 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)N(CC(=O)O)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm990115h | ||
CHEMBL2371518 | 208324 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCCNC(=O)CC[C@H](NC1=O)C(=O)N[C@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
44432635 | 86356 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232150 | 86356 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 512 | 8 | 2 | 3 | 6.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2C(C)(C)C2(C)C)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11262242 | 188152 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL505033 | 188152 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 6.1 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44434386 | 89378 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 638 | 11 | 2 | 8 | 5.1 | C#CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL237734 | 89378 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 638 | 11 | 2 | 8 | 5.1 | C#CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
86276160 | 109366 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 485 | 9 | 1 | 8 | 5.0 | COc1nc(OCCF)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL3233521 | 109366 | 0 | None | - | 1 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 485 | 9 | 1 | 8 | 5.0 | COc1nc(OCCF)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1016/j.bmcl.2014.02.002 | ||
44400229 | 68341 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL192171 | 68341 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL2371559 | 208340 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)NCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44432636 | 86957 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233341 | 86957 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 550 | 8 | 2 | 3 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C24CC5CC(CC(C5)C2)C4)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44432642 | 153060 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL398060 | 153060 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 574 | 9 | 2 | 3 | 6.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44287759 | 96249 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 999 | 12 | 2 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL264043 | 96249 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 999 | 12 | 2 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL407589 | 210923 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)N[C@@H](C)C(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL410382 | 211070 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC2=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL2371538 | 208331 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44347047 | 16422 | 0 | None | 5 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL124056 | 16422 | 0 | None | 5 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL264332 | 208868 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL2371531 | 208327 | 0 | None | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CNC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL412009 | 211223 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCCCC[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@@H]3CCCN3C2=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11168776 | 63279 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.4 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL180076 | 63279 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.4 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
44400352 | 67459 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 545 | 8 | 1 | 6 | 5.1 | CCOc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL190929 | 67459 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 545 | 8 | 1 | 6 | 5.1 | CCOc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL2371539 | 208332 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CCCCC1C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)[C@H](C)NC(=O)C[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
44378966 | 95997 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1336 | 26 | 15 | 17 | -3.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCC(=O)NC(=O)CC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
CHEMBL262160 | 95997 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 1336 | 26 | 15 | 17 | -3.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCC(=O)NC(=O)CC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
44432650 | 86344 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 703 | 10 | 3 | 5 | 6.5 | CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4c3CN(C(=O)Cc3c(F)cccc3C(F)(F)F)CC4)ccc2c1=O | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232097 | 86344 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 703 | 10 | 3 | 5 | 6.5 | CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c(-c4cc(C)cc(C)c4)[nH]c4c3CN(C(=O)Cc3c(F)cccc3C(F)(F)F)CC4)ccc2c1=O | 10.1016/j.bmcl.2007.05.009 | ||
44432640 | 154434 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL401226 | 154434 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 524 | 9 | 2 | 3 | 5.9 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
9854500 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL303274 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
9854500 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL303274 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
9854500 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL303274 | 101802 | 0 | None | -2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 953 | 11 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/s0960-894x(02)00370-0 | ||
11331001 | 188435 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
44576645 | 187613 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 571 | 9 | 2 | 8 | 3.6 | N[C@@H](Cn1c(=O)c(-c2ccc(COC(=O)CO)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL499026 | 187613 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 571 | 9 | 2 | 8 | 3.6 | N[C@@H](Cn1c(=O)c(-c2ccc(COC(=O)CO)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44353201 | 20847 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 650 | 15 | 2 | 7 | 6.3 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL131182 | 20847 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 650 | 15 | 2 | 7 | 6.3 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44394589 | 66586 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 4.1 | Cc1c(-c2cccs2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL186563 | 66586 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 4.1 | Cc1c(-c2cccs2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
11752130 | 14023 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119808 | 14023 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL405806 | 210836 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CC(=O)NCC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CCC(=O)O)NC1=O | 10.1021/jm990115h | ||||
44435979 | 88113 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 591 | 11 | 0 | 8 | 4.2 | CSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235269 | 88113 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 591 | 11 | 0 | 8 | 4.2 | CSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
44436017 | 88304 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 605 | 9 | 0 | 7 | 4.7 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236152 | 88304 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 605 | 9 | 0 | 7 | 4.7 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44435993 | 161132 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 665 | 10 | 0 | 8 | 5.9 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3C(F)(F)F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL413238 | 161132 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 665 | 10 | 0 | 8 | 5.9 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3C(F)(F)F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
44347085 | 15083 | 0 | None | -3 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121145 | 15083 | 0 | None | -3 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44587396 | 172685 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 603 | 10 | 2 | 7 | 4.9 | Cc1c(-c2cccc(OCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL452474 | 172685 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 603 | 10 | 2 | 7 | 4.9 | Cc1c(-c2cccc(OCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44343914 | 114311 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL334063 | 114311 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11330603 | 128156 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL366865 | 128156 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL430613 | 128156 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
11156980 | 62264 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 505 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL178281 | 62264 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 505 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
44353229 | 19990 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 580 | 11 | 1 | 7 | 6.5 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130487 | 19990 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 580 | 11 | 1 | 7 | 6.5 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44343914 | 114311 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL334063 | 114311 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
44309615 | 102196 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 655 | 10 | 0 | 7 | 7.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cc(Cl)cc(Cl)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL304548 | 102196 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 655 | 10 | 0 | 7 | 7.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cc(Cl)cc(Cl)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44435978 | 88069 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 575 | 11 | 0 | 8 | 3.5 | COc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235051 | 88069 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 575 | 11 | 0 | 8 | 3.5 | COc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
11284357 | 60692 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL176270 | 60692 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL72913 | 60692 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
44451476 | 95400 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 1535 | 30 | 8 | 18 | 8.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL258970 | 95400 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 1535 | 30 | 8 | 18 | 8.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44267883 | 16137 | 0 | None | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 780 | 9 | 2 | 11 | 5.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12265 | 16137 | 0 | None | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 780 | 9 | 2 | 11 | 5.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11249548 | 98633 | 0 | None | -97 | 2 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL280664 | 98633 | 0 | None | -97 | 2 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
44340637 | 9488 | 0 | None | 1479 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112466 | 9488 | 0 | None | 1479 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
21048269 | 110608 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 415 | 5 | 1 | 2 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccccc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL326313 | 110608 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 415 | 5 | 1 | 2 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccccc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21047785 | 15285 | 0 | None | 20 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ccnc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121576 | 15285 | 0 | None | 20 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ccnc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11227010 | 85238 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 580 | 12 | 0 | 9 | 3.9 | COc1cc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc(OC)c1OC | 10.1021/jm030472z | ||
CHEMBL22852 | 85238 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 580 | 12 | 0 | 9 | 3.9 | COc1cc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc(OC)c1OC | 10.1021/jm030472z | ||
CHEMBL438103 | 212002 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H]2NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]3CCCN3C2=O)NC1=O | 10.1021/jm990116+ | ||||
9807700 | 186719 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 553 | 8 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)Cc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL49297 | 186719 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 553 | 8 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)Cc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44346376 | 113307 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 622 | 10 | 1 | 7 | 7.3 | CCNc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332463 | 113307 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 622 | 10 | 1 | 7 | 7.3 | CCNc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
44309440 | 102161 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL304308 | 102161 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44387924 | 60156 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175465 | 60156 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21047534 | 16264 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 609 | 13 | 3 | 7 | 7.3 | COCCCNc1ccnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL123284 | 16264 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 609 | 13 | 3 | 7 | 7.3 | COCCCNc1ccnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
21047534 | 16264 | 0 | None | -1 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 609 | 13 | 3 | 7 | 7.3 | COCCCNc1ccnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL123284 | 16264 | 0 | None | -1 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 609 | 13 | 3 | 7 | 7.3 | COCCCNc1ccnc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL263542 | 208829 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC1=O | 10.1021/jm990116+ | ||||
12986401 | 187058 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 464 | 7 | 1 | 7 | 3.0 | COc1cccc(-n2c(=O)c(Cc3c(F)cccc3F)nn(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL494968 | 187058 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 464 | 7 | 1 | 7 | 3.0 | COc1cccc(-n2c(=O)c(Cc3c(F)cccc3F)nn(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
10226423 | 188819 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)[C@@H](c1ccccc1)CS2)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL513126 | 188819 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)[C@@H](c1ccccc1)CS2)c1ccccc1 | 10.1021/jm701249f | ||
11330034 | 83980 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 532 | 10 | 0 | 6 | 5.0 | Cc1c(-c2ccc(C(C)C)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL22196 | 83980 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 532 | 10 | 0 | 6 | 5.0 | Cc1c(-c2ccc(C(C)C)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
44593613 | 188074 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 598 | 11 | 2 | 8 | 4.2 | CCOC(=O)CNCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL503624 | 188074 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 598 | 11 | 2 | 8 | 4.2 | CCOC(=O)CNCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
44389658 | 62916 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL179101 | 62916 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
44309541 | 202176 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 647 | 12 | 0 | 9 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc(OC)c(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68753 | 202176 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 647 | 12 | 0 | 9 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc(OC)c(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44309439 | 202208 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 630 | 10 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68988 | 202208 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 630 | 10 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44593613 | 188074 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 598 | 11 | 2 | 8 | 4.2 | CCOC(=O)CNCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL503624 | 188074 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 598 | 11 | 2 | 8 | 4.2 | CCOC(=O)CNCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.07.059 | ||
21045834 | 16268 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4ncccn4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL123301 | 16268 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4ncccn4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44451367 | 59354 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 556 | 6 | 1 | 6 | 4.4 | Cc1ccc(CN2CCc3c(c(=O)n(CC4NCCc5ccccc54)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL172192 | 59354 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 556 | 6 | 1 | 6 | 4.4 | Cc1ccc(CN2CCc3c(c(=O)n(CC4NCCc5ccccc54)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.09.026 | ||
9892420 | 201451 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 506 | 10 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL64148 | 201451 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 506 | 10 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11294757 | 63507 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 489 | 8 | 0 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL180280 | 63507 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 489 | 8 | 0 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
44576643 | 187470 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 512 | 7 | 2 | 6 | 4.0 | NCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL497747 | 187470 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 512 | 7 | 2 | 6 | 4.0 | NCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
11329628 | 62695 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL178805 | 62695 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL73575 | 62695 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1016/j.bmcl.2004.02.004 | ||
10983979 | 201485 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 10 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccc3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL64252 | 201485 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 10 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccc3)c2=O)c1 | 10.1021/jm034041s | ||
44451485 | 157630 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1607 | 32 | 8 | 20 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2cccc(C#CCNC(=O)CNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL408759 | 157630 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1607 | 32 | 8 | 20 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2cccc(C#CCNC(=O)CNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
11226753 | 63014 | 0 | None | -389 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL179429 | 63014 | 0 | None | -389 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
9984259 | 110012 | 0 | None | -281 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
CHEMBL324912 | 110012 | 0 | None | -281 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
44267881 | 17889 | 0 | None | 14 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 877 | 10 | 1 | 12 | 6.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12666 | 17889 | 0 | None | 14 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 877 | 10 | 1 | 12 | 6.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44267876 | 97655 | 0 | None | -53 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 893 | 10 | 1 | 14 | 6.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273466 | 97655 | 0 | None | -53 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 893 | 10 | 1 | 14 | 6.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44309511 | 202553 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 624 | 13 | 1 | 9 | 5.3 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71141 | 202553 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 624 | 13 | 1 | 9 | 5.3 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44340788 | 9451 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112287 | 9451 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44343804 | 10472 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 517 | 10 | 1 | 6 | 4.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](CC(C)C)NC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL116976 | 10472 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 517 | 10 | 1 | 6 | 4.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](CC(C)C)NC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44343779 | 10919 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 529 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NC(C)C)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL117504 | 10919 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 529 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NC(C)C)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL2371488 | 208313 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@H](Cc3ccccc3)NC(=O)C[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
25156946 | 187785 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 617 | 11 | 2 | 7 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL501329 | 187785 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 617 | 11 | 2 | 7 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
11168634 | 84664 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 10 | 0 | 7 | 4.6 | CSc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL22459 | 84664 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 10 | 0 | 7 | 4.6 | CSc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
11226753 | 63014 | 0 | None | 389 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL179429 | 63014 | 0 | None | 389 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11180219 | 110733 | 0 | None | 112 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL326504 | 110733 | 0 | None | 112 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
44394723 | 123825 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 468 | 6 | 1 | 7 | 3.8 | Cc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL363659 | 123825 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 468 | 6 | 1 | 7 | 3.8 | Cc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
44400146 | 67231 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 570 | 9 | 1 | 8 | 3.0 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)N(C)C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL189984 | 67231 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 570 | 9 | 1 | 8 | 3.0 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)N(C)C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL2371493 | 208314 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCNC(=O)[C@@H](Cc3ccccc3)NC(=O)CC[C@H](NC1=O)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N2 | 10.1021/jm990115h | ||||
CHEMBL265232 | 208896 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
44432627 | 147596 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 430 | 7 | 2 | 3 | 4.5 | CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL393540 | 147596 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 430 | 7 | 2 | 3 | 4.5 | CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
44387880 | 60214 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175821 | 60214 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
44387979 | 60278 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 492 | 8 | 1 | 9 | 2.1 | COc1ccccc1Cn1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(-c2cccc(OC)c2F)c1=O | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL176020 | 60278 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 492 | 8 | 1 | 9 | 2.1 | COc1ccccc1Cn1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(-c2cccc(OC)c2F)c1=O | 10.1016/j.bmcl.2005.05.038 | ||
23450008 | 131885 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL369723 | 131885 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
44267904 | 97964 | 0 | None | 6 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275521 | 97964 | 0 | None | 6 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44352734 | 18329 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL127384 | 18329 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11443571 | 164260 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 9 | 0 | 6 | 4.0 | Cc1c(-c2cccc(F)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL421858 | 164260 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 9 | 0 | 6 | 4.0 | Cc1c(-c2cccc(F)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
11168176 | 122506 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL360910 | 122506 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL73526 | 122506 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
21047799 | 109914 | 0 | None | -6 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 559 | 9 | 2 | 5 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4c(C)noc4C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL324394 | 109914 | 0 | None | -6 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 559 | 9 | 2 | 5 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4c(C)noc4C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44340631 | 9417 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 471 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112131 | 9417 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 471 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11421412 | 178164 | 11 | None | -2398 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL468551 | 178164 | 11 | None | -2398 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 545 | 7 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
11763365 | 100733 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 551 | 7 | 0 | 7 | 5.4 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc4c(n3c2=O)CN(CCc2ccccn2)CC4(C)C)c1 | 10.1021/jm0205402 | ||
CHEMBL295807 | 100733 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 551 | 7 | 0 | 7 | 5.4 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc4c(n3c2=O)CN(CCc2ccccn2)CC4(C)C)c1 | 10.1021/jm0205402 | ||
9984259 | 110012 | 0 | None | -281 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
CHEMBL324912 | 110012 | 0 | None | -281 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
44309440 | 102161 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL304308 | 102161 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44267903 | 161683 | 0 | None | 3 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 906 | 10 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCN(C)C2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL416337 | 161683 | 0 | None | 3 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 906 | 10 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCN(C)C2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44389652 | 165471 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 473 | 6 | 1 | 7 | 3.5 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2)CO3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL425529 | 165471 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 473 | 6 | 1 | 7 | 3.5 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2)CO3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
10347081 | 89080 | 0 | None | -223 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23730 | 89080 | 0 | None | -223 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44435817 | 88675 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 489 | 6 | 0 | 6 | 3.9 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccccc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236544 | 88675 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 489 | 6 | 0 | 6 | 3.9 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccccc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL410452 | 211076 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL438901 | 212057 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H]1CSSC[C@@H]2NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm990116+ | ||||
44577101 | 177952 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 532 | 7 | 1 | 7 | 4.1 | COc1cccc(-c2nn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL466736 | 177952 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 532 | 7 | 1 | 7 | 4.1 | COc1cccc(-c2nn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
11249548 | 98633 | 0 | None | 97 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL280664 | 98633 | 0 | None | 97 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
11179420 | 63019 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 4.7 | CSc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1021/jm049218c | ||
CHEMBL179460 | 63019 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 4.7 | CSc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1021/jm049218c | ||
11341364 | 165533 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 519 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL425864 | 165533 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 519 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
44388018 | 60152 | 0 | None | 389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175443 | 60152 | 0 | None | 389 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
10050123 | 11078 | 0 | None | 20 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 464 | 6 | 2 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(N)=O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117863 | 11078 | 0 | None | 20 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 464 | 6 | 2 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(N)=O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44288074 | 99764 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 951 | 13 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL288534 | 99764 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 951 | 13 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
11179660 | 89282 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL23767 | 89282 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
10930118 | 101489 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 610 | 11 | 0 | 8 | 5.8 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccc1 | 10.1021/jm0205402 | ||
CHEMBL301322 | 101489 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 610 | 11 | 0 | 8 | 5.8 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)CCc1ccccc1 | 10.1021/jm0205402 | ||
11179660 | 89282 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23767 | 89282 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
44353254 | 21608 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 574 | 12 | 1 | 7 | 6.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)C)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL131942 | 21608 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 574 | 12 | 1 | 7 | 6.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)C)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
44394651 | 122410 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 573 | 8 | 2 | 8 | 5.8 | Cc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)c(C)c1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL360625 | 122410 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 573 | 8 | 2 | 8 | 5.8 | Cc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)c(C)c1 | 10.1016/j.bmcl.2004.07.022 | ||
44394685 | 126983 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 9 | 2 | 9 | 5.2 | COc1ccccc1Nc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL366127 | 126983 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 9 | 2 | 9 | 5.2 | COc1ccccc1Nc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
10951713 | 101778 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 546 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCC[C@H]3Cc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL303140 | 101778 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 546 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCC[C@H]3Cc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
44309573 | 201970 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 625 | 12 | 0 | 9 | 5.8 | CCN(CC)CCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL67370 | 201970 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 625 | 12 | 0 | 9 | 5.8 | CCN(CC)CCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL405961 | 210841 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CC(=O)NCCCC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
21045818 | 112597 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncccn4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331337 | 112597 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncccn4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44388018 | 60152 | 0 | None | -389 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175443 | 60152 | 0 | None | -389 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44436014 | 88158 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 568 | 7 | 0 | 6 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1C1CCCC1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235519 | 88158 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 568 | 7 | 0 | 6 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1C1CCCC1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44436016 | 147040 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 688 | 10 | 0 | 8 | 5.3 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@@H]1CCCN(C[C@@H]3CCCN3Cc3ccccn3)C1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL393093 | 147040 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 688 | 10 | 0 | 8 | 5.3 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@@H]1CCCN(C[C@@H]3CCCN3Cc3ccccn3)C1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44309535 | 102517 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL306684 | 102517 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44379747 | 96337 | 0 | None | -1 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1350 | 15 | 13 | 13 | 1.4 | CC(C)C[C@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)NCCC(=O)N2CC=C[C@H]2C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1C | 10.1021/jm990116+ | ||
CHEMBL264806 | 96337 | 0 | None | -1 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1350 | 15 | 13 | 13 | 1.4 | CC(C)C[C@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)NCCC(=O)N2CC=C[C@H]2C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1C | 10.1021/jm990116+ | ||
CHEMBL410451 | 211075 | 0 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
44577097 | 177916 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.4 | C=C1C(Cl)=CC=C1c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm701249f | ||
CHEMBL466531 | 177916 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.4 | C=C1C(Cl)=CC=C1c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm701249f | ||
11261693 | 63078 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1021/jm049218c | ||
CHEMBL179612 | 63078 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1021/jm049218c | ||
CHEMBL74721 | 63078 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1021/jm049218c | ||
44353270 | 114716 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 623 | 12 | 1 | 8 | 5.8 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL334537 | 114716 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 623 | 12 | 1 | 8 | 5.8 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44353230 | 116286 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 610 | 13 | 0 | 8 | 6.4 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL337748 | 116286 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 610 | 13 | 0 | 8 | 6.4 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44379747 | 96337 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1350 | 15 | 13 | 13 | 1.4 | CC(C)C[C@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)NCCC(=O)N2CC=C[C@H]2C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1C | 10.1021/jm990118u | ||
CHEMBL264806 | 96337 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 1350 | 15 | 13 | 13 | 1.4 | CC(C)C[C@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)NCCC(=O)N2CC=C[C@H]2C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1C | 10.1021/jm990118u | ||
44394567 | 65851 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccc(Cl)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL184345 | 65851 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccc(Cl)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
21047618 | 114032 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 635 | 11 | 3 | 7 | 7.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(C)c(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333574 | 114032 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 635 | 11 | 3 | 7 | 7.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(C)c(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44267874 | 96766 | 0 | None | 15 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 878 | 11 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL268489 | 96766 | 0 | None | 15 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 878 | 11 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11283517 | 95010 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL25714 | 95010 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11283517 | 95010 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL25714 | 95010 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
11330280 | 122536 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1021/jm049218c | ||
CHEMBL360934 | 122536 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1021/jm049218c | ||
CHEMBL72606 | 122536 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1021/jm049218c | ||
21047937 | 110809 | 0 | None | -1 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 7 | 1 | 3 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN(C)C)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL326606 | 110809 | 0 | None | -1 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 7 | 1 | 3 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN(C)C)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44312724 | 12294 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C(C)c1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL1185733 | 12294 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C(C)c1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL430618 | 12294 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C(C)c1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
44309616 | 202048 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 655 | 10 | 0 | 7 | 7.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(C(F)(F)F)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL67820 | 202048 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 655 | 10 | 0 | 7 | 7.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(C(F)(F)F)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
25113693 | 161365 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 896 | 15 | 3 | 10 | 6.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccccc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL415279 | 161365 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 896 | 15 | 3 | 10 | 6.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccccc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21047859 | 14048 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL119856 | 14048 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
11376064 | 166586 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.0 | COCc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL429062 | 166586 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.0 | COCc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
44400147 | 67316 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 612 | 9 | 1 | 9 | 2.7 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)N3CCOCC3)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL190676 | 67316 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 612 | 9 | 1 | 9 | 2.7 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)N3CCOCC3)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44309403 | 202207 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccncc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68985 | 202207 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 631 | 10 | 0 | 9 | 6.1 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccncc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44435994 | 146510 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 8 | 0 | 6 | 3.0 | CCc1ccc(CN2CCc3c(c(=O)n(CCN(C)C)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392688 | 146510 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 8 | 0 | 6 | 3.0 | CCc1ccc(CN2CCc3c(c(=O)n(CCN(C)C)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
44267811 | 96767 | 0 | None | 14 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 864 | 12 | 1 | 12 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL268491 | 96767 | 0 | None | 14 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 864 | 12 | 1 | 12 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
21047807 | 112487 | 0 | None | -23 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 568 | 8 | 3 | 7 | 6.4 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncc(C#N)c(N)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331087 | 112487 | 0 | None | -23 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 568 | 8 | 3 | 7 | 6.4 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncc(C#N)c(N)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11249167 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL23854 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL216526 | 207585 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H]2NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@@H]3CCCN3C2=O)NC(=O)[C@@H](Cc2cccnc2)NC1=O | 10.1021/jm990116+ | ||||
44435979 | 88113 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 591 | 11 | 0 | 8 | 4.2 | CSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1021/jm701249f | ||
CHEMBL235269 | 88113 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 591 | 11 | 0 | 8 | 4.2 | CSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1021/jm701249f | ||
11249167 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL23854 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
11214860 | 84347 | 0 | None | 323 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
CHEMBL22314 | 84347 | 0 | None | 323 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
11249167 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23854 | 89869 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
11192229 | 122603 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL361128 | 122603 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11168776 | 63279 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.4 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL180076 | 63279 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.4 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
44394661 | 65779 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 564 | 7 | 1 | 7 | 5.8 | Cc1c(-c2csc(-c3ccc(Cl)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL183938 | 65779 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 564 | 7 | 1 | 7 | 5.8 | Cc1c(-c2csc(-c3ccc(Cl)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44435982 | 57791 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 605 | 12 | 0 | 8 | 4.6 | CCSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL16745 | 57791 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 605 | 12 | 0 | 8 | 4.6 | CCSc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
44435986 | 96058 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 615 | 10 | 0 | 8 | 5.0 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL262579 | 96058 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 615 | 10 | 0 | 8 | 5.0 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
44587398 | 188448 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 659 | 13 | 1 | 7 | 6.3 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@@H](c2ccccc2)N(C)C)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL509267 | 188448 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 659 | 13 | 1 | 7 | 6.3 | Cc1c(-c2cccc(OCCCCC(=O)O)c2F)c(=O)n(C[C@@H](c2ccccc2)N(C)C)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
11214860 | 84347 | 0 | None | 323 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
CHEMBL22314 | 84347 | 0 | None | 323 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
44267812 | 97652 | 0 | None | -64 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 941 | 10 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273440 | 97652 | 0 | None | -64 | 3 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 941 | 10 | 1 | 14 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44394753 | 122786 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 7 | 1 | 7 | 6.2 | Cc1c(-c2csc(-c3cccc(C(F)(F)F)c3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL361513 | 122786 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 7 | 1 | 7 | 6.2 | Cc1c(-c2csc(-c3cccc(C(F)(F)F)c3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44346261 | 113370 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 651 | 10 | 2 | 8 | 5.7 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332570 | 113370 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 651 | 10 | 2 | 8 | 5.7 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44340720 | 9616 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL113183 | 9616 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44309296 | 201887 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 584 | 10 | 0 | 9 | 5.1 | COCCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL66808 | 201887 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 584 | 10 | 0 | 9 | 5.1 | COCCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
21045833 | 113192 | 0 | None | 11 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncccn4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL332305 | 113192 | 0 | None | 11 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncccn4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11330072 | 86509 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.0 | COCc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23231 | 86509 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.0 | COCc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44394835 | 122118 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 539 | 7 | 1 | 9 | 3.3 | Cc1c(-c2csc(N3CCOCC3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL360384 | 122118 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 539 | 7 | 1 | 9 | 3.3 | Cc1c(-c2csc(N3CCOCC3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44387885 | 131774 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 2.4 | COc1cccc(-n2c(=O)n(CC[C@H](N)CC(C)C)c(=O)n(Cc3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL369706 | 131774 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 492 | 9 | 1 | 8 | 2.4 | COc1cccc(-n2c(=O)n(CC[C@H](N)CC(C)C)c(=O)n(Cc3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44341075 | 9815 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 427 | 5 | 1 | 6 | 2.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCNC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL114370 | 9815 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 427 | 5 | 1 | 6 | 2.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCNC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44353266 | 116587 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 14 | 2 | 6 | 6.9 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL339273 | 116587 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 14 | 2 | 6 | 6.9 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
21045817 | 114052 | 0 | None | -22 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNc4ncccn4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333730 | 114052 | 0 | None | -22 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNc4ncccn4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44587401 | 187650 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 660 | 14 | 3 | 8 | 4.7 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCNCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL499442 | 187650 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 660 | 14 | 3 | 8 | 4.7 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCNCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
21048323 | 167149 | 0 | None | -8 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 421 | 5 | 1 | 2 | 6.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL430250 | 167149 | 0 | None | -8 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 421 | 5 | 1 | 2 | 6.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44435819 | 88765 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 490 | 6 | 0 | 7 | 3.3 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccncc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236750 | 88765 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 490 | 6 | 0 | 7 | 3.3 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccncc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
11225960 | 10906 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL117396 | 10906 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
11225960 | 10906 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL117396 | 10906 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
44346375 | 15190 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 690 | 9 | 1 | 7 | 7.3 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)C(F)(F)F)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL121441 | 15190 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 690 | 9 | 1 | 7 | 7.3 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)C(F)(F)F)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
9891852 | 10000 | 0 | None | 23 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL115482 | 10000 | 0 | None | 23 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
9959327 | 101486 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 553 | 9 | 1 | 7 | 5.7 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL301285 | 101486 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 553 | 9 | 1 | 7 | 5.7 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44394714 | 122113 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 590 | 9 | 2 | 10 | 5.1 | Cc1c(-c2csc(Nc3ccc([N+](=O)[O-])cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL360363 | 122113 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 590 | 9 | 2 | 10 | 5.1 | Cc1c(-c2csc(Nc3ccc([N+](=O)[O-])cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
10347081 | 89080 | 0 | None | 223 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23730 | 89080 | 0 | None | 223 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44436009 | 88931 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 8 | 0 | 6 | 5.4 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(Cc5ccccc5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236966 | 88931 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 8 | 0 | 6 | 5.4 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(Cc5ccccc5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44340845 | 9777 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 469 | 9 | 1 | 6 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL114183 | 9777 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 469 | 9 | 1 | 6 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44432656 | 158612 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 645 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL409825 | 158612 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 645 | 9 | 3 | 5 | 6.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44451397 | 95458 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 856 | 16 | 4 | 10 | 5.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL259220 | 95458 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 856 | 16 | 4 | 10 | 5.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44434373 | 89617 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 637 | 11 | 3 | 7 | 4.6 | C#CCNC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL238160 | 89617 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 637 | 11 | 3 | 7 | 4.6 | C#CCNC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44267881 | 17889 | 0 | None | -14 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 877 | 10 | 1 | 12 | 6.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12666 | 17889 | 0 | None | -14 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 877 | 10 | 1 | 12 | 6.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL406628 | 210869 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
CHEMBL415179 | 211430 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H]2NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@@H](CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]3CCCN3C2=O)NC1=O | 10.1021/jm990116+ | ||||
44353276 | 116724 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 697 | 15 | 2 | 6 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCCc4ccccc4)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL339468 | 116724 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 697 | 15 | 2 | 6 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCCc4ccccc4)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
44346479 | 113626 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 650 | 11 | 1 | 7 | 7.9 | CC(C)CNc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332837 | 113626 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 650 | 11 | 1 | 7 | 7.9 | CC(C)CNc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
44435977 | 88298 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 579 | 10 | 0 | 7 | 4.1 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236127 | 88298 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 579 | 10 | 0 | 7 | 4.1 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
9911446 | 10681 | 0 | None | 33 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(C#N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117170 | 10681 | 0 | None | 33 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(C#N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44340785 | 114305 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL334037 | 114305 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11467328 | 86317 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 580 | 9 | 0 | 7 | 5.8 | Cc1c(-c2ccc3oc4ccccc4c3c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL23198 | 86317 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 580 | 9 | 0 | 7 | 5.8 | Cc1c(-c2ccc3oc4ccccc4c3c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
44346398 | 14369 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL120260 | 14369 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 638 | 10 | 0 | 8 | 6.8 | CN(CCc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44346663 | 114317 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 592 | 10 | 0 | 9 | 5.2 | COCCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL334110 | 114317 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 592 | 10 | 0 | 9 | 5.2 | COCCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44451396 | 156132 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 842 | 16 | 4 | 10 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL406958 | 156132 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 842 | 16 | 4 | 10 | 5.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21047815 | 14779 | 0 | None | 30 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120834 | 14779 | 0 | None | 30 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11733484 | 186262 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 476 | 6 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)C)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL48944 | 186262 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 476 | 6 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)C)n3c2=O)c1 | 10.1021/jm0205402 | ||
11168176 | 122506 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL360910 | 122506 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL73526 | 122506 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 397 | 7 | 1 | 6 | 2.5 | COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
10874838 | 100351 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 506 | 10 | 0 | 7 | 3.6 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL293247 | 100351 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 506 | 10 | 0 | 7 | 3.6 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
44435998 | 145762 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 522 | 6 | 0 | 6 | 4.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392087 | 145762 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 522 | 6 | 0 | 6 | 4.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
21047631 | 10858 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CN)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117330 | 10858 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CN)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44346848 | 112571 | 0 | None | 1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331204 | 112571 | 0 | None | 1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
21045833 | 113192 | 0 | None | -11 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncccn4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL332305 | 113192 | 0 | None | -11 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncccn4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11318370 | 9610 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL113151 | 9610 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44394857 | 123839 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 544 | 7 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL363731 | 123839 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 544 | 7 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
44400204 | 167993 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 517 | 6 | 2 | 6 | 4.4 | N[C@@H](Cn1c(=O)c(-c2cccc(O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL435689 | 167993 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 517 | 6 | 2 | 6 | 4.4 | N[C@@H](Cn1c(=O)c(-c2cccc(O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
44309390 | 167558 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc(OC)cc4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL432922 | 167558 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc(OC)cc4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44432628 | 87327 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL233762 | 87327 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 8 | 2 | 3 | 5.7 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)C2CCCC2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44387961 | 165468 | 0 | None | 144 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL425523 | 165468 | 0 | None | 144 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44267864 | 167195 | 0 | None | 30 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CCC1CN(C(=O)O[C@H]2[C@H](C)[C@@H](OC3O[C@H](C)C[C@H](N(C)C(C)C)[C@H]3O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]3N(CCc4ccc(Cl)cc4)C(=O)O[C@]3(C)[C@@H](CC)OC(=O)[C@@H]2C)C(=O)O1 | 10.1021/jm030418i | ||
CHEMBL430312 | 167195 | 0 | None | 30 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CCC1CN(C(=O)O[C@H]2[C@H](C)[C@@H](OC3O[C@H](C)C[C@H](N(C)C(C)C)[C@H]3O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]3N(CCc4ccc(Cl)cc4)C(=O)O[C@]3(C)[C@@H](CC)OC(=O)[C@@H]2C)C(=O)O1 | 10.1021/jm030418i | ||
44267902 | 97952 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL275467 | 97952 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44287893 | 162654 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 919 | 11 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL418256 | 162654 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 919 | 11 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44267902 | 97952 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275467 | 97952 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44352665 | 117771 | 0 | None | 43 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL340934 | 117771 | 0 | None | 43 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11319703 | 122579 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 529 | 7 | 1 | 6 | 5.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1SC(F)(F)F | 10.1021/jm049218c | ||
CHEMBL361016 | 122579 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 529 | 7 | 1 | 6 | 5.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1SC(F)(F)F | 10.1021/jm049218c | ||
15462666 | 96055 | 4 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL262557 | 96055 | 4 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 624 | 9 | 0 | 8 | 6.7 | CN(Cc1ccccc1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44435996 | 88357 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 559 | 9 | 0 | 7 | 4.0 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)Cc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236342 | 88357 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 559 | 9 | 0 | 7 | 4.0 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)Cc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44387926 | 130093 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 528 | 8 | 1 | 8 | 3.2 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3Cl)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL368153 | 130093 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 528 | 8 | 1 | 8 | 3.2 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3Cl)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
21047799 | 109914 | 0 | None | 6 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 559 | 9 | 2 | 5 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4c(C)noc4C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL324394 | 109914 | 0 | None | 6 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 559 | 9 | 2 | 5 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4c(C)noc4C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21048323 | 167149 | 0 | None | 8 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 421 | 5 | 1 | 2 | 6.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL430250 | 167149 | 0 | None | 8 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 421 | 5 | 1 | 2 | 6.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
9851194 | 116184 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 578 | 10 | 0 | 8 | 5.6 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL337172 | 116184 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 578 | 10 | 0 | 8 | 5.6 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44341057 | 162805 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL419212 | 162805 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44435995 | 88301 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 524 | 9 | 0 | 6 | 4.1 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CC(C)C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236137 | 88301 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 524 | 9 | 0 | 6 | 4.1 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CC(C)C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44340649 | 109147 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 415 | 6 | 1 | 6 | 2.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL322283 | 109147 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 415 | 6 | 1 | 6 | 2.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11214294 | 121681 | 0 | None | -912 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL359754 | 121681 | 0 | None | -912 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
11467134 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm701249f | ||
CHEMBL361798 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm701249f | ||
CHEMBL74686 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm701249f | ||
44400099 | 126904 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 509 | 8 | 1 | 7 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3SC)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL366020 | 126904 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 509 | 8 | 1 | 7 | 4.4 | COc1cccc(-c2cn(Cc3c(F)cccc3SC)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
10962804 | 101325 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 566 | 9 | 0 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL300080 | 101325 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 566 | 9 | 0 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44448991 | 154802 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403234 | 154802 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL556355 | 154802 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 583 | 9 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
44353246 | 20021 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 538 | 9 | 1 | 7 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130513 | 20021 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 538 | 9 | 1 | 7 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44340635 | 9598 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 471 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL113068 | 9598 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 471 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44288078 | 156539 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 910 | 11 | 2 | 14 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL40743 | 156539 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 910 | 11 | 2 | 14 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL317064 | 209451 | 13 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
44451349 | 95705 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 508 | 6 | 1 | 6 | 3.5 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCNCC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL260540 | 95705 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 508 | 6 | 1 | 6 | 3.5 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCNCC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.09.026 | ||
44434438 | 145662 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 1707 | 45 | 6 | 28 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392008 | 145662 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 1707 | 45 | 6 | 28 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44267875 | 15394 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 879 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12204 | 15394 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 879 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
10323198 | 123845 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 4.7 | Cc1c(-c2ccc(Cl)s2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL363759 | 123845 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 4.7 | Cc1c(-c2ccc(Cl)s2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
10323198 | 123845 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 4.7 | Cc1c(-c2ccc(Cl)s2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL363759 | 123845 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 4.7 | Cc1c(-c2ccc(Cl)s2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44432657 | 148935 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 635 | 10 | 3 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(C(=O)O)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL394613 | 148935 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 635 | 10 | 3 | 3 | 7.2 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccc(C(=O)O)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11671279 | 130362 | 0 | None | 331 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL368511 | 130362 | 0 | None | 331 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44353262 | 116315 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 664 | 15 | 1 | 7 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL337919 | 116315 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 664 | 15 | 1 | 7 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
25156400 | 188272 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 581 | 12 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL506877 | 188272 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 581 | 12 | 2 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
21036877 | 173078 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL453441 | 173078 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 627 | 13 | 2 | 7 | 5.9 | Cc1c(-c2cccc(OCCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
44267876 | 97655 | 0 | None | 53 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 893 | 10 | 1 | 14 | 6.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273466 | 97655 | 0 | None | 53 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 893 | 10 | 1 | 14 | 6.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11331001 | 188435 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL509075 | 188435 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.2 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
1179 | 947 | 31 | None | 1 | 3 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
9957278 | 947 | 31 | None | 1 | 3 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL494803 | 947 | 31 | None | 1 | 3 | Mouse | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL2371556 | 208337 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCCNC(=O)CCNC(=O)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371558 | 208339 | 0 | None | - | 1 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)NCCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL439470 | 212093 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
16058727 | 193151 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 548 | 7 | 1 | 7 | 4.6 | COc1cccc(-c2nn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1021/jm701249f | ||
CHEMBL539167 | 193151 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 548 | 7 | 1 | 7 | 4.6 | COc1cccc(-c2nn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl | 10.1021/jm701249f | ||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL2371498 | 208315 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)C(C)(C)OC(C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
71459935 | 78548 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 4.5 | COc1cccc(N2CN(Cc3c(F)cccc3F)C(=O)N(C[C@H](N)c3ccccc3)C2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL2113012 | 78548 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 4.5 | COc1cccc(N2CN(Cc3c(F)cccc3F)C(=O)N(C[C@H](N)c3ccccc3)C2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
11466452 | 114238 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 515 | 8 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C3CCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL333850 | 114238 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 515 | 8 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C3CCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL2371560 | 208341 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@H](C)C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL410819 | 211099 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)N[C@@H]1CSSC[C@@H](C(=O)N2CCC[C@@H]2C(=O)NCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O)C(=O)O | 10.1021/jm990115h | ||||
44347085 | 15083 | 0 | None | 3 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121145 | 15083 | 0 | None | 3 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44400350 | 126475 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 531 | 6 | 1 | 5 | 5.5 | Cc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL365561 | 126475 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 531 | 6 | 1 | 5 | 5.5 | Cc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2005.03.057 | ||
44432641 | 166942 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 540 | 9 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2Cl)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL429976 | 166942 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 540 | 9 | 2 | 3 | 6.4 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2Cl)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
9831160 | 162918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL419998 | 162918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
9831160 | 162918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL419998 | 162918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 665 | 15 | 1 | 8 | 7.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL385505 | 210606 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCCN)N(C(C)C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC2=O)NC(=O)[C@@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11168311 | 165689 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL426783 | 165689 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
10077844 | 103308 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 637 | 13 | 1 | 8 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL308910 | 103308 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 637 | 13 | 1 | 8 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44267869 | 97668 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)O[C@H](C)[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273535 | 97668 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)O[C@H](C)[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44267902 | 97952 | 0 | None | 6 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275467 | 97952 | 0 | None | 6 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL405265 | 210805 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCC(=O)NCC[C@@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
10919567 | 98573 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 664 | 10 | 1 | 7 | 7.4 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL280213 | 98573 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 664 | 10 | 1 | 7 | 7.4 | CC(C)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
10347081 | 89080 | 0 | None | 223 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23730 | 89080 | 0 | None | 223 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1021/jm030472z | ||
11467134 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm049218c | ||
CHEMBL361798 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm049218c | ||
CHEMBL74686 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1021/jm049218c | ||
11272935 | 131265 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL369326 | 131265 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
CHEMBL75954 | 131265 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1021/jm049218c | ||
44449186 | 95108 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 565 | 9 | 1 | 6 | 5.7 | CC[C@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL257599 | 95108 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 565 | 9 | 1 | 6 | 5.7 | CC[C@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
44394615 | 125364 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 572 | 7 | 1 | 8 | 5.1 | Cc1c(-c2csc(-c3ccc4c(c3)CCO4)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL364840 | 125364 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 572 | 7 | 1 | 8 | 5.1 | Cc1c(-c2csc(-c3ccc4c(c3)CCO4)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
10007333 | 9511 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(CNC[C@@H](C)n2c(=O)c(-c3cccc(OC)c3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112559 | 9511 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(CNC[C@@H](C)n2c(=O)c(-c3cccc(OC)c3)c(C)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
10347081 | 89080 | 0 | None | 223 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23730 | 89080 | 0 | None | 223 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
10098618 | 110842 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL326804 | 110842 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11467134 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL361798 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL74686 | 123036 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F | 10.1016/j.bmcl.2004.02.004 | ||
44379092 | 157308 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1337 | 26 | 15 | 14 | -0.6 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
CHEMBL408372 | 157308 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1337 | 26 | 15 | 14 | -0.6 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||
44435975 | 91747 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 573 | 11 | 0 | 7 | 4.0 | CCc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL242399 | 91747 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 573 | 11 | 0 | 7 | 4.0 | CCc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
44436015 | 147038 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 591 | 8 | 0 | 7 | 4.6 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1Cc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL393092 | 147038 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 591 | 8 | 0 | 7 | 4.6 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCN1Cc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44387907 | 60357 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 516 | 7 | 1 | 8 | 2.5 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL176056 | 60357 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 516 | 7 | 1 | 8 | 2.5 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)c3ccccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44387992 | 62196 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 496 | 7 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(Cc3ccccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL178218 | 62196 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 496 | 7 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(Cc3ccccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21045797 | 170035 | 0 | None | 12 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNC(=O)C(F)(F)F)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL445074 | 170035 | 0 | None | 12 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNC(=O)C(F)(F)F)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL2371581 | 208349 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | CCCCC1C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)CNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)N1 | 10.1021/jm9901172 | ||||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
44343975 | 10477 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 586 | 11 | 0 | 8 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL116988 | 10477 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 586 | 11 | 0 | 8 | 5.3 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
11238637 | 67230 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 585 | 6 | 1 | 5 | 6.3 | N[C@@H](Cn1c(=O)c(-c2ccc(C(F)(F)F)cc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL189964 | 67230 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 585 | 6 | 1 | 5 | 6.3 | N[C@@H](Cn1c(=O)c(-c2ccc(C(F)(F)F)cc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
11330280 | 122536 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL360934 | 122536 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL72606 | 122536 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 435 | 6 | 1 | 5 | 4.4 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
9983568 | 98525 | 0 | None | 263 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL279885 | 98525 | 0 | None | 263 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
44352801 | 20143 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL130607 | 20143 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44340670 | 9550 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112730 | 9550 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL317341 | 209456 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
44287779 | 141042 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 979 | 12 | 2 | 14 | 7.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL384920 | 141042 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 979 | 12 | 2 | 14 | 7.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
21046762 | 10476 | 0 | None | -9 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 464 | 5 | 3 | 3 | 4.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116986 | 10476 | 0 | None | -9 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 464 | 5 | 3 | 3 | 4.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44267885 | 17639 | 0 | None | -9 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 892 | 10 | 2 | 13 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCNC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12589 | 17639 | 0 | None | -9 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 892 | 10 | 2 | 13 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCNC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44267811 | 96767 | 0 | None | -14 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 864 | 12 | 1 | 12 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL268491 | 96767 | 0 | None | -14 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 864 | 12 | 1 | 12 | 7.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44380024 | 168467 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1459 | 18 | 13 | 14 | 2.4 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC1=O | 10.1021/jm990116+ | ||
91931289 | 168467 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1459 | 18 | 13 | 14 | 2.4 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC1=O | 10.1021/jm990116+ | ||
CHEMBL439439 | 168467 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1459 | 18 | 13 | 14 | 2.4 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC1=O | 10.1021/jm990116+ | ||
CHEMBL407855 | 210942 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CC(=O)NC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
11490288 | 168082 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1021/jm049218c | ||
CHEMBL436276 | 168082 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1021/jm049218c | ||
CHEMBL75439 | 168082 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1021/jm049218c | ||
44353304 | 18826 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 664 | 15 | 2 | 7 | 6.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL128810 | 18826 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 664 | 15 | 2 | 7 | 6.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL2371498 | 208315 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)C(C)(C)OC(C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
11354193 | 95767 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 640 | 9 | 1 | 8 | 3.8 | COc1ccc(CN2CC3CC(c4ccc(N(C)C)c5ccccc45)N4C(=O)N(CCN5CCOCC5)C(=O)C34C2)cc1NC(C)=O | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL260816 | 95767 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 640 | 9 | 1 | 8 | 3.8 | COc1ccc(CN2CC3CC(c4ccc(N(C)C)c5ccccc45)N4C(=O)N(CCN5CCOCC5)C(=O)C34C2)cc1NC(C)=O | 10.1016/j.bmc.2007.09.026 | ||
44340783 | 167336 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H]3CCCN3Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL431248 | 167336 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H]3CCCN3Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44394577 | 122706 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 559 | 8 | 2 | 8 | 5.5 | Cc1ccccc1Nc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL361313 | 122706 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 559 | 8 | 2 | 8 | 5.5 | Cc1ccccc1Nc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
44352513 | 117597 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 635 | 11 | 0 | 10 | 4.9 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC4CCOC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL340677 | 117597 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 635 | 11 | 0 | 10 | 4.9 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC4CCOC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
44340637 | 9488 | 0 | None | -1479 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112466 | 9488 | 0 | None | -1479 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44267874 | 96766 | 0 | None | -15 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 878 | 11 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL268489 | 96766 | 0 | None | -15 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 878 | 11 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
21047785 | 15285 | 0 | None | -20 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ccnc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121576 | 15285 | 0 | None | -20 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ccnc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44267885 | 17639 | 0 | None | 9 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 892 | 10 | 2 | 13 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCNC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12589 | 17639 | 0 | None | 9 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 892 | 10 | 2 | 13 | 5.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCNC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11191153 | 193201 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL540207 | 193201 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
44576679 | 192835 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 567 | 12 | 2 | 7 | 4.3 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL526327 | 192835 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 567 | 12 | 2 | 7 | 4.3 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
21047516 | 15173 | 0 | None | 1 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 595 | 12 | 3 | 7 | 6.9 | COCCNc1nccc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121412 | 15173 | 0 | None | 1 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 595 | 12 | 3 | 7 | 6.9 | COCCNc1nccc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
44267810 | 97640 | 0 | None | -5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL273387 | 97640 | 0 | None | -5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44267810 | 97640 | 0 | None | -5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273387 | 97640 | 0 | None | -5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44577067 | 192634 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 477 | 5 | 1 | 6 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL523709 | 192634 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 477 | 5 | 1 | 6 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1021/jm701249f | ||
11352630 | 88280 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 504 | 9 | 0 | 6 | 4.2 | Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL23604 | 88280 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 504 | 9 | 0 | 6 | 4.2 | Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
22716564 | 123273 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 477 | 5 | 1 | 6 | 4.4 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL362283 | 123273 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 477 | 5 | 1 | 6 | 4.4 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
10994908 | 162458 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 518 | 10 | 0 | 6 | 4.4 | CCc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL417558 | 162458 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 518 | 10 | 0 | 6 | 4.4 | CCc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
44309321 | 202155 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 582 | 10 | 0 | 8 | 6.3 | CCCCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68625 | 202155 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 582 | 10 | 0 | 8 | 6.3 | CCCCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12 | 10.1016/s0960-894x(02)00371-2 | ||
21046762 | 10476 | 0 | None | 9 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 464 | 5 | 3 | 3 | 4.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116986 | 10476 | 0 | None | 9 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 464 | 5 | 3 | 3 | 4.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21047538 | 14389 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 555 | 8 | 3 | 6 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(F)c(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120397 | 14389 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 555 | 8 | 3 | 6 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(F)c(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44390769 | 64540 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 486 | 6 | 1 | 7 | 2.5 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL182145 | 64540 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 486 | 6 | 1 | 7 | 2.5 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
44309323 | 202350 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 601 | 12 | 1 | 8 | 6.0 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN2CCCC2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL69914 | 202350 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 601 | 12 | 1 | 8 | 6.0 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN2CCCC2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44352735 | 117943 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 647 | 14 | 0 | 10 | 6.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL341124 | 117943 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 647 | 14 | 0 | 10 | 6.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11071561 | 101981 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.1 | CCc1c(-c2cccc(OC)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL304002 | 101981 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.1 | CCc1c(-c2cccc(OC)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44435820 | 160794 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 542 | 7 | 1 | 6 | 4.4 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(CCc2c[nH]c4ccccc24)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL412581 | 160794 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 542 | 7 | 1 | 6 | 4.4 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(CCc2c[nH]c4ccccc24)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
44451460 | 155907 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1691 | 34 | 8 | 20 | 10.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@@H](NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)C(C)C)c2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL406713 | 155907 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1691 | 34 | 8 | 20 | 10.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@@H](NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)C(C)C)c2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
11191675 | 63052 | 0 | None | -186 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL179600 | 63052 | 0 | None | -186 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL3085404 | 63052 | 0 | None | -186 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
9958318 | 89796 | 0 | None | -15 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23830 | 89796 | 0 | None | -15 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL266536 | 208942 | 0 | None | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
44577051 | 186847 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 509 | 7 | 1 | 6 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)(N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL493794 | 186847 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 509 | 7 | 1 | 6 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)(N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44344157 | 110888 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 543 | 9 | 1 | 6 | 5.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NC(C)C)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL327076 | 110888 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 543 | 9 | 1 | 6 | 5.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](NC(C)C)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
44434404 | 166015 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1477 | 33 | 4 | 24 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL427981 | 166015 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 1477 | 33 | 4 | 24 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44309582 | 202501 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 569 | 11 | 0 | 9 | 4.6 | CCOC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL70851 | 202501 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 569 | 11 | 0 | 9 | 4.6 | CCOC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
44389658 | 62916 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CS2)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL179101 | 62916 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 5 | 1 | 6 | 4.2 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CS2)c1ccccc1 | 10.1021/jm701249f | ||
12991507 | 186993 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 461 | 5 | 1 | 6 | 3.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CO2)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL494621 | 186993 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 461 | 5 | 1 | 6 | 3.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CO2)c1ccccc1 | 10.1021/jm701249f | ||
10940289 | 90217 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL23900 | 90217 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
44312821 | 11958 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 409 | 8 | 1 | 5 | 4.0 | CCCCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL1183624 | 11958 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 409 | 8 | 1 | 5 | 4.0 | CCCCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL308154 | 11958 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 409 | 8 | 1 | 5 | 4.0 | CCCCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
11330603 | 128156 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL366865 | 128156 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL430613 | 128156 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 3.9 | COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
22716524 | 123139 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 461 | 5 | 1 | 6 | 3.6 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CO2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL362025 | 123139 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 461 | 5 | 1 | 6 | 3.6 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1F)CO2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
10940289 | 90217 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm034041s | ||
CHEMBL23900 | 90217 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm034041s | ||
44309525 | 102799 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 611 | 13 | 0 | 9 | 5.8 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL308446 | 102799 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 611 | 13 | 0 | 9 | 5.8 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00371-2 | ||
10557573 | 110959 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 870 | 22 | 9 | 8 | 3.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)N1C(=O)N[C@H](Cc2c[nH]c3ccccc23)C1=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||
CHEMBL327528 | 110959 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 870 | 22 | 9 | 8 | 3.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)N1C(=O)N[C@H](Cc2c[nH]c3ccccc23)C1=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||
11671279 | 130362 | 0 | None | -331 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL368511 | 130362 | 0 | None | -331 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44346848 | 112571 | 0 | None | -1 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331204 | 112571 | 0 | None | -1 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
10929667 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL22929 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
10929667 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL22929 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44388002 | 121872 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CC[C@H](N)c3ccccc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL360047 | 121872 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CC[C@H](N)c3ccccc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21047784 | 110148 | 0 | None | 36 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 574 | 9 | 4 | 7 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4cc(O)nc(O)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL325747 | 110148 | 0 | None | 36 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 574 | 9 | 4 | 7 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4cc(O)nc(O)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21046570 | 112588 | 0 | None | 34 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 479 | 6 | 1 | 4 | 6.2 | COC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL331277 | 112588 | 0 | None | 34 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 479 | 6 | 1 | 4 | 6.2 | COC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
11671279 | 130362 | 0 | None | 331 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL368511 | 130362 | 0 | None | 331 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 558 | 7 | 1 | 8 | 3.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Br)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
10929667 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL22929 | 85345 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 548 | 9 | 0 | 8 | 3.7 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmc.2007.09.026 | ||
44340780 | 9657 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 543 | 13 | 0 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)CCCOCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL113455 | 9657 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 543 | 13 | 0 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)CCCOCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
10929574 | 100665 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 8 | 1 | 6 | 6.3 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL295275 | 100665 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 8 | 1 | 6 | 6.3 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
11421243 | 90229 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 532 | 10 | 0 | 6 | 5.0 | Cc1c(-c2cccc(C(C)C)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL23908 | 90229 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 532 | 10 | 0 | 6 | 5.0 | Cc1c(-c2cccc(C(C)C)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
21048269 | 110608 | 0 | None | -2 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 415 | 5 | 1 | 2 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccccc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL326313 | 110608 | 0 | None | -2 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 415 | 5 | 1 | 2 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccccc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
11123821 | 201616 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 491 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCc3ccccc3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL64795 | 201616 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 491 | 9 | 1 | 6 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCc3ccccc3)c2=O)c1 | 10.1021/jm034041s | ||
44387961 | 165468 | 0 | None | 144 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL425523 | 165468 | 0 | None | 144 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44352548 | 168009 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2cccc(F)c2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL435793 | 168009 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2cccc(F)c2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44343932 | 168007 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 561 | 10 | 0 | 8 | 5.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)Cc3ccco3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL435784 | 168007 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 561 | 10 | 0 | 8 | 5.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)Cc3ccco3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
44436004 | 88318 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 619 | 9 | 0 | 7 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@@H]1CCCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236197 | 88318 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 619 | 9 | 0 | 7 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@@H]1CCCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44436005 | 88686 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 508 | 6 | 1 | 6 | 3.5 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCNC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236550 | 88686 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 508 | 6 | 1 | 6 | 3.5 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCNC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
10439527 | 168913 | 0 | None | 288 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 677 | 15 | 0 | 9 | 7.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL443027 | 168913 | 0 | None | 288 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 677 | 15 | 0 | 9 | 7.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11477970 | 89069 | 0 | None | 281 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23729 | 89069 | 0 | None | 281 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
44436002 | 146563 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 599 | 8 | 0 | 7 | 5.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4Cc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392731 | 146563 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 599 | 8 | 0 | 7 | 5.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4Cc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44340784 | 9412 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112093 | 9412 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
21045797 | 170035 | 0 | None | -12 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNC(=O)C(F)(F)F)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL445074 | 170035 | 0 | None | -12 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNC(=O)C(F)(F)F)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44340804 | 9060 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccc(F)cc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL110052 | 9060 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccc(F)cc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
9825757 | 109669 | 0 | None | 12 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 465 | 6 | 2 | 3 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL323687 | 109669 | 0 | None | 12 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 465 | 6 | 2 | 3 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44340636 | 110753 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 415 | 6 | 1 | 6 | 2.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL326510 | 110753 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 415 | 6 | 1 | 6 | 2.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44352514 | 18689 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 659 | 13 | 0 | 9 | 6.3 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC(C4CC4)C4CC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL128262 | 18689 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 659 | 13 | 0 | 9 | 6.3 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC(C4CC4)C4CC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
44309252 | 202137 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 9 | 0 | 7 | 5.5 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(Br)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68537 | 202137 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 9 | 0 | 7 | 5.5 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(Br)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44451385 | 95631 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 580 | 10 | 0 | 7 | 4.4 | CC(C)CN(C)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(OC(F)(F)F)cc1)C2 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL260058 | 95631 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 580 | 10 | 0 | 7 | 4.4 | CC(C)CN(C)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(OC(F)(F)F)cc1)C2 | 10.1016/j.bmc.2007.09.026 | ||
11477970 | 89069 | 0 | None | -281 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23729 | 89069 | 0 | None | -281 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
44267883 | 16137 | 0 | None | 3 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 780 | 9 | 2 | 11 | 5.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12265 | 16137 | 0 | None | 3 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 780 | 9 | 2 | 11 | 5.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44435985 | 146417 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 613 | 10 | 0 | 7 | 4.8 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)c(Cl)c1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392604 | 146417 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 613 | 10 | 0 | 7 | 4.8 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)c(Cl)c1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44436008 | 88930 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 576 | 7 | 0 | 6 | 5.2 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(C5CCCC5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236965 | 88930 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 576 | 7 | 0 | 6 | 5.2 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(C5CCCC5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44435999 | 146565 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 564 | 8 | 0 | 6 | 5.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4CC(C)C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392733 | 146565 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 564 | 8 | 0 | 6 | 5.0 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4CC(C)C)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44394818 | 165566 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 530 | 7 | 1 | 7 | 5.1 | Cc1c(-c2csc(-c3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL426058 | 165566 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 530 | 7 | 1 | 7 | 5.1 | Cc1c(-c2csc(-c3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
21045828 | 14395 | 0 | None | 2 | 2 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(NCC5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120420 | 14395 | 0 | None | 2 | 2 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(NCC5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44352515 | 116570 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 633 | 11 | 0 | 9 | 6.0 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC4CCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL339211 | 116570 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 633 | 11 | 0 | 9 | 6.0 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC4CCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
11766904 | 186059 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 561 | 11 | 0 | 7 | 5.7 | CCN(CC)CCN(C)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
CHEMBL48806 | 186059 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 561 | 11 | 0 | 7 | 5.7 | CCN(CC)CCN(C)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
44312666 | 11964 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 421 | 5 | 1 | 5 | 4.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL1183666 | 11964 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 421 | 5 | 1 | 5 | 4.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL310716 | 11964 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 421 | 5 | 1 | 5 | 4.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C1CCCCC1 | 10.1016/j.bmcl.2004.02.004 | ||
44451319 | 95728 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 882 | 15 | 3 | 10 | 6.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL260647 | 95728 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 882 | 15 | 3 | 10 | 6.0 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44352874 | 22117 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 575 | 11 | 0 | 9 | 4.9 | CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL132387 | 22117 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 575 | 11 | 0 | 9 | 4.9 | CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44343976 | 10478 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 571 | 10 | 0 | 7 | 5.9 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL116989 | 10478 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 571 | 10 | 0 | 7 | 5.9 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3cccc(OC)c3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
11319401 | 121629 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 489 | 8 | 0 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL359681 | 121629 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 489 | 8 | 0 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11261693 | 63078 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL179612 | 63078 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL74721 | 63078 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
44587399 | 188037 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 646 | 13 | 3 | 8 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCNCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL502967 | 188037 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 646 | 13 | 3 | 8 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCNCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
44387908 | 62859 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 500 | 8 | 1 | 9 | 2.6 | COc1cccc(-n2c(=O)n(CCC(N)c3cccs3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL179023 | 62859 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 500 | 8 | 1 | 9 | 2.6 | COc1cccc(-n2c(=O)n(CCC(N)c3cccs3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
44287778 | 81168 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 993 | 15 | 2 | 14 | 7.8 | CCC(C)N(CC1CC1)[C@H]1C[C@@H](C)OC(O[C@@H]2[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]3(C)OC(=O)N(CCc4ccc(Cl)cc4)[C@@H]3[C@@H](C)C(=O)[C@H](C)C[C@]2(C)OC)[C@@H]1O | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL216252 | 81168 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 993 | 15 | 2 | 14 | 7.8 | CCC(C)N(CC1CC1)[C@H]1C[C@@H](C)OC(O[C@@H]2[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]3(C)OC(=O)N(CCc4ccc(Cl)cc4)[C@@H]3[C@@H](C)C(=O)[C@H](C)C[C@]2(C)OC)[C@@H]1O | 10.1016/j.bmcl.2003.12.059 | ||
44353264 | 22051 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 608 | 10 | 0 | 9 | 5.5 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)cc2n(Cc3ccccc3F)cc(C3=NC(C)(C)CO3)c(=O)n12 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL132339 | 22051 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 608 | 10 | 0 | 9 | 5.5 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)cc2n(Cc3ccccc3F)cc(C3=NC(C)(C)CO3)c(=O)n12 | 10.1016/s0960-894x(01)00780-6 | ||
10050123 | 11078 | 0 | None | -20 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 464 | 6 | 2 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(N)=O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117863 | 11078 | 0 | None | -20 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 464 | 6 | 2 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(N)=O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44394852 | 126644 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 497 | 8 | 2 | 8 | 3.9 | CCNc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL365695 | 126644 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 497 | 8 | 2 | 8 | 3.9 | CCNc1nc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cs1 | 10.1016/j.bmcl.2004.07.022 | ||
44346374 | 113930 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 590 | 10 | 0 | 8 | 6.3 | CCCCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL333233 | 113930 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 590 | 10 | 0 | 8 | 6.3 | CCCCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
21045823 | 113643 | 0 | None | -40 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=O)C(F)(F)F)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL332923 | 113643 | 0 | None | -40 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=O)C(F)(F)F)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21046387 | 110163 | 0 | None | -53 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 6.6 | CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL325843 | 110163 | 0 | None | -53 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 6.6 | CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
44267863 | 98066 | 0 | None | 2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 950 | 12 | 1 | 14 | 7.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL276217 | 98066 | 0 | None | 2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 950 | 12 | 1 | 14 | 7.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44387935 | 61770 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 494 | 8 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(CN)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL177523 | 61770 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 494 | 8 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(CN)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
44347004 | 15275 | 0 | None | 13 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121535 | 15275 | 0 | None | 13 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44340798 | 108300 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL320920 | 108300 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
21047859 | 14048 | 0 | None | -1 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL119856 | 14048 | 0 | None | -1 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44340644 | 9821 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 517 | 7 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCN(Cc4ccccc4)C3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL114399 | 9821 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 517 | 7 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCN(Cc4ccccc4)C3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44309399 | 202205 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 518 | 10 | 1 | 7 | 5.4 | CCCC(=O)Nc1ccc(-c2cn3c(=O)c(C(=O)OC(CC)CC)cn(Cc4ccccc4F)c3n2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL68964 | 202205 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 518 | 10 | 1 | 7 | 5.4 | CCCC(=O)Nc1ccc(-c2cn3c(=O)c(C(=O)OC(CC)CC)cn(Cc4ccccc4F)c3n2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44352566 | 20458 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3cccnc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL130861 | 20458 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3cccnc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44309361 | 102262 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 582 | 7 | 0 | 9 | 4.9 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN2CCOCC2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL304950 | 102262 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 582 | 7 | 0 | 9 | 4.9 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN2CCOCC2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44309585 | 202674 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 641 | 14 | 1 | 9 | 6.7 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2ccco2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL71793 | 202674 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 641 | 14 | 1 | 9 | 6.7 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2ccco2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44587405 | 171674 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 673 | 13 | 2 | 7 | 6.6 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCC(C)(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL447424 | 171674 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 673 | 13 | 2 | 7 | 6.6 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCC(C)(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
44387918 | 60336 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 2.4 | COc1cccc(-n2c(=O)n(Cc3ccccc3C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL176029 | 60336 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 2.4 | COc1cccc(-n2c(=O)n(Cc3ccccc3C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21047519 | 14301 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 6.8 | Cc1cc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc(N)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120048 | 14301 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 6.8 | Cc1cc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc(N)n1 | 10.1016/s0960-894x(02)00756-4 | ||
44434411 | 146220 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1521 | 36 | 4 | 25 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL392434 | 146220 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 1521 | 36 | 4 | 25 | 9.5 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2nc(-c3ccc(NC(=O)NCc4cn(CCOCCOCCOCCn5cc(CNC(=O)Nc6ccc(-c7nc8n(Cc9c(F)cccc9F)cc(C(=O)OCC)c(=O)n8c7CN(C)Cc7ccccc7)cc6)nn5)nn4)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.04.065 | ||
44309375 | 103142 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 651 | 11 | 1 | 8 | 7.0 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2N2CCC3C=CC=CC3C2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL308696 | 103142 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 651 | 11 | 1 | 8 | 7.0 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2N2CCC3C=CC=CC3C2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
10345138 | 122042 | 0 | None | -2041 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL360143 | 122042 | 0 | None | -2041 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL75347 | 122042 | 0 | None | -2041 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
11226470 | 162519 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 538 | 10 | 0 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL417645 | 162519 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 538 | 10 | 0 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
10027591 | 125750 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 467 | 6 | 1 | 6 | 4.4 | Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)s1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL365012 | 125750 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 467 | 6 | 1 | 6 | 4.4 | Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)s1 | 10.1016/j.bmcl.2004.07.022 | ||
44387977 | 60196 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 548 | 7 | 1 | 8 | 3.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175711 | 60196 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 548 | 7 | 1 | 8 | 3.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44347048 | 14344 | 0 | None | 18 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120164 | 14344 | 0 | None | 18 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL438374 | 212019 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NCC(=O)NCC[C@@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
11375759 | 63504 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 479 | 6 | 1 | 5 | 4.5 | Cc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL180262 | 63504 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 479 | 6 | 1 | 5 | 4.5 | Cc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
11444886 | 122115 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1021/jm049218c | ||
CHEMBL308289 | 122115 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1021/jm049218c | ||
CHEMBL360367 | 122115 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1021/jm049218c | ||
11467552 | 172142 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL450471 | 172142 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2008.04.029 | ||
44576644 | 188388 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 581 | 9 | 1 | 7 | 5.0 | N[C@@H](Cn1c(=O)c(-c2ccc(COC(=O)C3CC3)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL508435 | 188388 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 581 | 9 | 1 | 7 | 5.0 | N[C@@H](Cn1c(=O)c(-c2ccc(COC(=O)C3CC3)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44353285 | 117231 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 678 | 17 | 2 | 7 | 7.1 | CCCCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL340156 | 117231 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 678 | 17 | 2 | 7 | 7.1 | CCCCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL2371585 | 208353 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@@H](C)C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44378834 | 96380 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1291 | 24 | 12 | 15 | -0.1 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2cccnc2)NC1=O | 10.1021/jm990115h | ||
CHEMBL265169 | 96380 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1291 | 24 | 12 | 15 | -0.1 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2cccnc2)NC1=O | 10.1021/jm990115h | ||
11455317 | 62559 | 0 | None | 851 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL178457 | 62559 | 0 | None | 851 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
11467552 | 172142 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL450471 | 172142 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 603 | 11 | 2 | 6 | 5.7 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44576680 | 172969 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 627 | 13 | 2 | 9 | 3.6 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL453167 | 172969 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 627 | 13 | 2 | 9 | 3.6 | COc1cccc(-c2cn(Cc3c(F)cccc3S(C)(=O)=O)c(=O)n(C[C@H](NCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
11191675 | 63052 | 0 | None | 186 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL179600 | 63052 | 0 | None | 186 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL3085404 | 63052 | 0 | None | 186 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm049218c | ||
11456285 | 188347 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 613 | 12 | 2 | 8 | 4.1 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL508020 | 188347 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 613 | 12 | 2 | 8 | 4.1 | CS(=O)(=O)c1cccc(F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](NCCCC(=O)O)c2ccccc2)c1=O | 10.1016/j.bmcl.2008.04.036 | ||
44379006 | 168388 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1257 | 22 | 13 | 15 | -1.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CC(=O)NCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC1=O | 10.1021/jm990115h | ||
CHEMBL438899 | 168388 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1257 | 22 | 13 | 15 | -1.9 | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CC(=O)NCC(=O)Nc2ccc(cc2)C[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC1=O | 10.1021/jm990115h | ||
11421518 | 164744 | 0 | None | 1047 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm701249f | ||
CHEMBL423291 | 164744 | 0 | None | 1047 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm701249f | ||
44449095 | 154971 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 581 | 9 | 1 | 6 | 6.2 | CC[C@@H](Cn1c(=O)c(-c2cccc(OC)c2Cl)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL404180 | 154971 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 581 | 9 | 1 | 6 | 6.2 | CC[C@@H](Cn1c(=O)c(-c2cccc(OC)c2Cl)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
25156942 | 188082 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 645 | 12 | 1 | 7 | 5.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](c3ccccc3)N(C)CCCC(=O)O)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL503705 | 188082 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 645 | 12 | 1 | 7 | 5.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](c3ccccc3)N(C)CCCC(=O)O)c2=O)c1F | 10.1021/jm8006454 | ||
1179 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1021/jm701249f | ||
9957278 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1021/jm701249f | ||
CHEMBL494803 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1021/jm701249f | ||
44353258 | 115580 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 650 | 14 | 1 | 7 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL335647 | 115580 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 650 | 14 | 1 | 7 | 7.7 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
1179 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
9957278 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL494803 | 947 | 31 | None | -1 | 3 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
44267868 | 97624 | 0 | None | -10 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL273275 | 97624 | 0 | None | -10 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
11421518 | 164744 | 0 | None | 1047 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL423291 | 164744 | 0 | None | 1047 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
44388511 | 123150 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 515 | 6 | 1 | 5 | 5.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cc(F)ccc1C(F)(F)F | 10.1021/jm049218c | ||
CHEMBL362065 | 123150 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 515 | 6 | 1 | 5 | 5.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cc(F)ccc1C(F)(F)F | 10.1021/jm049218c | ||
9850211 | 187694 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 539 | 8 | 1 | 7 | 5.7 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL50009 | 187694 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 539 | 8 | 1 | 7 | 5.7 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
10886383 | 199223 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 582 | 11 | 0 | 7 | 5.7 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL60153 | 199223 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 582 | 11 | 0 | 7 | 5.7 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
44394901 | 66030 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 564 | 7 | 1 | 7 | 5.8 | Cc1c(-c2csc(-c3ccccc3Cl)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL185154 | 66030 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 564 | 7 | 1 | 7 | 5.8 | Cc1c(-c2csc(-c3ccccc3Cl)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44400246 | 67314 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 569 | 9 | 1 | 8 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)C(C)C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL190671 | 67314 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 569 | 9 | 1 | 8 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)C(C)C)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
10886383 | 199223 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 582 | 11 | 0 | 7 | 5.7 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL60153 | 199223 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 582 | 11 | 0 | 7 | 5.7 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44436003 | 88302 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 619 | 9 | 0 | 7 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236142 | 88302 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 619 | 9 | 0 | 7 | 5.0 | O=c1c2c(n(Cc3c(F)cccc3F)c(=O)n1C[C@H]1CCCCN1CCc1ccccn1)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44435980 | 146414 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 613 | 10 | 0 | 7 | 4.5 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C(F)(F)F)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392602 | 146414 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 613 | 10 | 0 | 7 | 4.5 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C(F)(F)F)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
11421518 | 164744 | 0 | None | 1047 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL423291 | 164744 | 0 | None | 1047 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
44309376 | 202406 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 600 | 13 | 1 | 9 | 5.4 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CC#N)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL70276 | 202406 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 600 | 13 | 1 | 9 | 5.4 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CC#N)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
10929801 | 101467 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 564 | 11 | 0 | 9 | 4.2 | COCCN(C)Cc1c(C(C)(C)C(=O)OC)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
CHEMBL301103 | 101467 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 564 | 11 | 0 | 9 | 4.2 | COCCN(C)Cc1c(C(C)(C)C(=O)OC)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
44346349 | 113471 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 679 | 12 | 2 | 8 | 6.5 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CCCN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332616 | 113471 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 679 | 12 | 2 | 8 | 6.5 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CCCN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44435976 | 88068 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 601 | 10 | 0 | 7 | 4.8 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C(C)(C)C)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235050 | 88068 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 601 | 10 | 0 | 7 | 4.8 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C(C)(C)C)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
21047805 | 113951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 588 | 10 | 2 | 7 | 7.0 | COc1cc(OC)nc(NCC2CCC(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)CC2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333349 | 113951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 588 | 10 | 2 | 7 | 7.0 | COc1cc(OC)nc(NCC2CCC(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)CC2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
11167850 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
1178 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
1187 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL179691 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm701249f | ||
11167850 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1178 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
1187 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL179691 | 2701 | 22 | None | -6309 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm049218c | ||
9825757 | 109669 | 0 | None | -12 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 465 | 6 | 2 | 3 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL323687 | 109669 | 0 | None | -12 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 465 | 6 | 2 | 3 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44394893 | 129148 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 469 | 6 | 2 | 8 | 3.1 | Cc1c(-c2csc(N)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL367369 | 129148 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 469 | 6 | 2 | 8 | 3.1 | Cc1c(-c2csc(N)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44451418 | 168152 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1620 | 32 | 9 | 19 | 8.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@H](C)NC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL436878 | 168152 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1620 | 32 | 9 | 19 | 8.2 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@H](C)NC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44309522 | 96079 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 476 | 8 | 1 | 7 | 4.3 | CCCC(=O)Nc1ccc(-c2cn3c(=O)c(C(=O)OCC)cn(Cc4ccccc4F)c3n2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL262787 | 96079 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 476 | 8 | 1 | 7 | 4.3 | CCCC(=O)Nc1ccc(-c2cn3c(=O)c(C(=O)OCC)cn(Cc4ccccc4F)c3n2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44435991 | 146422 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 579 | 10 | 0 | 8 | 4.7 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3ccccc3)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392607 | 146422 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 579 | 10 | 0 | 8 | 4.7 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3ccccc3)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
44352652 | 116981 | 0 | None | 245 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 689 | 14 | 0 | 9 | 7.6 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC4CCCC4)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL339968 | 116981 | 0 | None | 245 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 689 | 14 | 0 | 9 | 7.6 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC4CCCC4)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL2371532 | 208328 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371584 | 208352 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44340825 | 167518 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL432585 | 167518 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44400255 | 134207 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 577 | 7 | 1 | 7 | 4.5 | CS(=O)(=O)c1cccc(C(F)(F)F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL371855 | 134207 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 577 | 7 | 1 | 7 | 4.5 | CS(=O)(=O)c1cccc(C(F)(F)F)c1Cn1cc(-c2ccccc2Cl)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2005.03.057 | ||
44340808 | 110078 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H]3CCCN3Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL325326 | 110078 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H]3CCCN3Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44593615 | 174049 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 5.3 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL455769 | 174049 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 5.3 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44353200 | 20769 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 676 | 13 | 2 | 7 | 6.8 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC4CCCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL131127 | 20769 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 676 | 13 | 2 | 7 | 6.8 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC4CCCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
44593615 | 174049 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 5.3 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL455769 | 174049 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 12 | 1 | 8 | 5.3 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
10995320 | 187587 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 562 | 11 | 0 | 8 | 5.4 | CCCCN(C)Cc1c(C(C)(C)C(=O)OC)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
CHEMBL49872 | 187587 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 562 | 11 | 0 | 8 | 5.4 | CCCCN(C)Cc1c(C(C)(C)C(=O)OC)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
11785958 | 86611 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23256 | 86611 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1021/jm030472z | ||
11785958 | 86611 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23256 | 86611 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3OC)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44327851 | 110960 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 872 | 11 | 9 | 8 | 3.3 | CC[C@H](C)[C@@H]1NC(=O)CSC[C@@H](C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]([C@@H](C)CC)NC1=O | 10.1021/jm990432o | ||
CHEMBL327529 | 110960 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 872 | 11 | 9 | 8 | 3.3 | CC[C@H](C)[C@@H]1NC(=O)CSC[C@@H](C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]([C@@H](C)CC)NC1=O | 10.1021/jm990432o | ||
11180219 | 110733 | 0 | None | -112 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL326504 | 110733 | 0 | None | -112 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
11226531 | 99059 | 0 | None | -169 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL283381 | 99059 | 0 | None | -169 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
44451331 | 159334 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 4.8 | NC(CC1CCCCC1)Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL410680 | 159334 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 4.8 | NC(CC1CCCCC1)Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2 | 10.1016/j.bmc.2007.09.026 | ||
21048462 | 109828 | 0 | None | -60 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 522 | 5 | 1 | 4 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL323863 | 109828 | 0 | None | -60 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 522 | 5 | 1 | 4 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44352657 | 21351 | 0 | None | 269 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 687 | 12 | 0 | 9 | 7.3 | CN(CCc1ccccn1)Cc1c(-c2ccc(OC3CCCC3)cc2)c(C#N)c2n(Cc3ccccc3F)cc(C(=O)OC3CCCC3)c(=O)n12 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL131665 | 21351 | 0 | None | 269 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 687 | 12 | 0 | 9 | 7.3 | CN(CCc1ccccn1)Cc1c(-c2ccc(OC3CCCC3)cc2)c(C#N)c2n(Cc3ccccc3F)cc(C(=O)OC3CCCC3)c(=O)n12 | 10.1016/s0960-894x(01)00779-x | ||
24857895 | 154781 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL403081 | 154781 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 551 | 8 | 1 | 6 | 5.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
44394768 | 123864 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 605 | 10 | 2 | 10 | 5.2 | COc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1OC | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL363900 | 123864 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 605 | 10 | 2 | 10 | 5.2 | COc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1OC | 10.1016/j.bmcl.2004.07.022 | ||
11490288 | 168082 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL436276 | 168082 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL75439 | 168082 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl | 10.1016/j.bmcl.2004.02.004 | ||
44587392 | 169974 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 13 | 2 | 7 | 5.7 | N[C@@H](Cn1c(=O)c(-c2cccc(OCCCCCC(=O)O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL444989 | 169974 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 631 | 13 | 2 | 7 | 5.7 | N[C@@H](Cn1c(=O)c(-c2cccc(OCCCCCC(=O)O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
21045805 | 13672 | 0 | None | -5 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL119546 | 13672 | 0 | None | -5 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
21045829 | 112899 | 0 | None | 1 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4nccc(NCC5CCCO5)n4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331855 | 112899 | 0 | None | 1 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4nccc(NCC5CCCO5)n4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44340771 | 9623 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL113216 | 9623 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 9 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44451398 | 168130 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1676 | 34 | 9 | 19 | 9.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@@H](NC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)C(C)C)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL436697 | 168130 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1676 | 34 | 9 | 19 | 9.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@@H](NC(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)C(C)C)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44577096 | 178163 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 524 | 10 | 0 | 7 | 3.7 | COc1cccc(-c2c(F)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL468546 | 178163 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 524 | 10 | 0 | 7 | 3.7 | COc1cccc(-c2c(F)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44394649 | 129650 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 8 | 1 | 8 | 5.2 | Cc1c(-c2csc(N(C)c3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL367812 | 129650 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 8 | 1 | 8 | 5.2 | Cc1c(-c2csc(N(C)c3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm049791w | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm049791w | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
9892420 | 201451 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 506 | 10 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL64148 | 201451 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 506 | 10 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
44587391 | 171998 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.4 | N[C@@H](Cn1c(=O)c(-c2cccc(OCCCCC(=O)O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL448656 | 171998 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 617 | 12 | 2 | 7 | 5.4 | N[C@@H](Cn1c(=O)c(-c2cccc(OCCCCC(=O)O)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
11352834 | 88761 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 516 | 10 | 0 | 6 | 4.5 | C=Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL23673 | 88761 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 516 | 10 | 0 | 6 | 4.5 | C=Cc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
44394614 | 66608 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 9 | 2 | 8 | 5.1 | Cc1c(-c2csc(NCc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL186646 | 66608 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 9 | 2 | 8 | 5.1 | Cc1c(-c2csc(NCc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
11272935 | 131265 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL369326 | 131265 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL75954 | 131265 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 4.2 | Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O | 10.1016/j.bmcl.2004.02.004 | ||
44435829 | 88159 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 10 | 0 | 7 | 3.8 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235520 | 88159 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 559 | 10 | 0 | 7 | 3.8 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)cc1 | 10.1016/j.bmc.2007.05.029 | ||
44587402 | 172136 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 674 | 14 | 2 | 8 | 5.1 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCN(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL450414 | 172136 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 674 | 14 | 2 | 8 | 5.1 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCN(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
21047518 | 15276 | 0 | None | 10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 571 | 8 | 3 | 6 | 7.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4cc(Cl)nc(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121551 | 15276 | 0 | None | 10 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 571 | 8 | 3 | 6 | 7.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4cc(Cl)nc(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11145953 | 183418 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 539 | 10 | 1 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)CNCCc4ccccn4)cn3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL48193 | 183418 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 539 | 10 | 1 | 7 | 5.2 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)CNCCc4ccccn4)cn3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL2371565 | 208342 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CC(=O)N[C@@H](C)C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44309576 | 101798 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 619 | 15 | 1 | 9 | 5.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCOC)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL303260 | 101798 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 619 | 15 | 1 | 9 | 5.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCOC)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
10919052 | 113020 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332138 | 113020 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 7 | 6.4 | CN(Cc1ccccc1)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44387988 | 131323 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 530 | 7 | 1 | 8 | 3.4 | COc1cccc(-n2c(=O)n(Cc3c(Cl)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL369453 | 131323 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 530 | 7 | 1 | 8 | 3.4 | COc1cccc(-n2c(=O)n(Cc3c(Cl)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44267866 | 96665 | 0 | None | -4 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CC(C)OC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL267568 | 96665 | 0 | None | -4 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CC(C)OC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44346260 | 114326 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 665 | 11 | 2 | 8 | 6.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CCN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL334148 | 114326 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 665 | 11 | 2 | 8 | 6.1 | CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)CCN)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
11225384 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL366701 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm701249f | ||
11225384 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL366701 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
11225384 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL366701 | 127983 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 480 | 7 | 1 | 8 | 2.2 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
11375912 | 84799 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 524 | 9 | 0 | 6 | 4.5 | Cc1c(-c2cccc(Cl)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL22559 | 84799 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 524 | 9 | 0 | 6 | 4.5 | Cc1c(-c2cccc(Cl)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
11260648 | 167474 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL432262 | 167474 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
11260648 | 167474 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL432262 | 167474 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44309372 | 202165 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 677 | 13 | 0 | 10 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cc(OC)c(OC)c(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL68698 | 202165 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 677 | 13 | 0 | 10 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cc(OC)c(OC)c(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44347004 | 15275 | 0 | None | -13 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121535 | 15275 | 0 | None | -13 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CNc4ccnc(NC[C@@H]5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44352933 | 21293 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL131589 | 21293 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44576657 | 187664 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 587 | 10 | 2 | 7 | 4.9 | N[C@@H](Cn1c(=O)c(-c2ccc(CSCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL499589 | 187664 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 587 | 10 | 2 | 7 | 4.9 | N[C@@H](Cn1c(=O)c(-c2ccc(CSCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
11005990 | 89493 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 534 | 9 | 0 | 8 | 3.6 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL23797 | 89493 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 534 | 9 | 0 | 8 | 3.6 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
11005990 | 89493 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 534 | 9 | 0 | 8 | 3.6 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL23797 | 89493 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 534 | 9 | 0 | 8 | 3.6 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44587404 | 188453 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 661 | 14 | 2 | 8 | 5.2 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCOCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL509347 | 188453 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 661 | 14 | 2 | 8 | 5.2 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCCOCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
44267868 | 97624 | 0 | None | -10 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273275 | 97624 | 0 | None | -10 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 933 | 10 | 1 | 14 | 7.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44435990 | 96059 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 585 | 10 | 0 | 8 | 5.2 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3CC3CCCCC3)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL262580 | 96059 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 585 | 10 | 0 | 8 | 5.2 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3CC3CCCCC3)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
44451342 | 96018 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 898 | 20 | 4 | 10 | 6.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL262334 | 96018 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 898 | 20 | 4 | 10 | 6.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21047518 | 15276 | 0 | None | -10 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 571 | 8 | 3 | 6 | 7.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4cc(Cl)nc(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121551 | 15276 | 0 | None | -10 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 571 | 8 | 3 | 6 | 7.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4cc(Cl)nc(N)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44390795 | 121664 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 539 | 7 | 2 | 7 | 2.8 | NC(Cc1c[nH]c2ccccc12)Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL359741 | 121664 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 539 | 7 | 2 | 7 | 2.8 | NC(Cc1c[nH]c2ccccc12)Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2c(F)cccc2F)c1=O | 10.1016/j.bmcl.2004.11.026 | ||
11113778 | 201432 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 495 | 10 | 2 | 7 | 2.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3c[nH]cn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL64066 | 201432 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 495 | 10 | 2 | 7 | 2.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCCc3c[nH]cn3)c2=O)c1 | 10.1021/jm034041s | ||
9891852 | 10000 | 0 | None | -23 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL115482 | 10000 | 0 | None | -23 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
11178994 | 10304 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL116259 | 10304 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11178994 | 10304 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL116259 | 10304 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44593614 | 187679 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 570 | 10 | 3 | 7 | 3.8 | N[C@@H](Cn1c(=O)c(-c2ccc(CNCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL499849 | 187679 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 570 | 10 | 3 | 7 | 3.8 | N[C@@H](Cn1c(=O)c(-c2ccc(CNCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44593614 | 187679 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 570 | 10 | 3 | 7 | 3.8 | N[C@@H](Cn1c(=O)c(-c2ccc(CNCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL499849 | 187679 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 570 | 10 | 3 | 7 | 3.8 | N[C@@H](Cn1c(=O)c(-c2ccc(CNCC(=O)O)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
11226531 | 99059 | 0 | None | 169 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL283381 | 99059 | 0 | None | 169 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
44353228 | 19889 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 622 | 12 | 1 | 7 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130400 | 19889 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 622 | 12 | 1 | 7 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44400187 | 134760 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 551 | 6 | 1 | 5 | 5.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2C(F)(F)F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL372680 | 134760 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 551 | 6 | 1 | 5 | 5.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2C(F)(F)F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
11444886 | 122115 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL308289 | 122115 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL360367 | 122115 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 497 | 6 | 1 | 5 | 4.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F | 10.1016/j.bmcl.2004.02.004 | ||
10649568 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL120432 | 14397 | 0 | None | -10 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 517 | 7 | 3 | 6 | 4.9 | Cc1cc(-c2c(OCC[C@@H]3CCN3)c3cc(C(=O)Nc4ccncn4)c(Cl)cc3[nH]c2=O)cc(C)c1C | 10.1016/s0960-894x(03)00746-7 | ||
9983568 | 98525 | 0 | None | 263 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL279885 | 98525 | 0 | None | 263 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
11283954 | 13982 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 529 | 8 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C3CCCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119774 | 13982 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 529 | 8 | 0 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C3CCCCC3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44346667 | 113244 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332355 | 113244 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 636 | 9 | 1 | 7 | 6.8 | CC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
44587393 | 172065 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 613 | 12 | 2 | 7 | 5.5 | Cc1c(-c2cccc(OCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL449468 | 172065 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 613 | 12 | 2 | 7 | 5.5 | Cc1c(-c2cccc(OCCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
10995569 | 101214 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 597 | 10 | 0 | 9 | 5.1 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccn1 | 10.1021/jm0205402 | ||
CHEMBL299348 | 101214 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 597 | 10 | 0 | 9 | 5.1 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccn1 | 10.1021/jm0205402 | ||
44449156 | 154505 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 565 | 9 | 1 | 6 | 5.7 | CC[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL401632 | 154505 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 565 | 9 | 1 | 6 | 5.7 | CC[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL2371583 | 208351 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)NCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
CHEMBL2371479 | 208307 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CC[C@H]1NC(=O)CC[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](Cc3cccnc3)NC(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC(C)=O)CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCNC1=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC2=O | 10.1021/jm990115h | ||||
25156944 | 188523 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 645 | 12 | 1 | 8 | 5.6 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/jm8006454 | ||
CHEMBL510285 | 188523 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 645 | 12 | 1 | 8 | 5.6 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1021/jm8006454 | ||
44577098 | 177949 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 539 | 8 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3[S+](C)[O-])c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL466730 | 177949 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 539 | 8 | 1 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3[S+](C)[O-])c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44267810 | 97640 | 0 | None | 5 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273387 | 97640 | 0 | None | 5 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 939 | 12 | 2 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11214614 | 188839 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 523 | 6 | 1 | 7 | 4.9 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1Cl | 10.1021/jm701249f | ||
CHEMBL513346 | 188839 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 523 | 6 | 1 | 7 | 4.9 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1Cl | 10.1021/jm701249f | ||
10051739 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL22653 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
10051739 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL22653 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
44449682 | 95600 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 533 | 8 | 1 | 6 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL259907 | 95600 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 533 | 8 | 1 | 6 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1 | 10.1016/j.bmcl.2008.04.029 | ||
10051739 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL22653 | 85008 | 0 | None | 501 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
22716581 | 122008 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 523 | 6 | 1 | 7 | 4.9 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1Cl | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL360126 | 122008 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 523 | 6 | 1 | 7 | 4.9 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1Cl | 10.1016/j.bmcl.2005.01.009 | ||
44432638 | 86357 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232151 | 86357 | 0 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 506 | 9 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)Cc2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
11490509 | 63034 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 507 | 6 | 1 | 5 | 4.6 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Br | 10.1021/jm049218c | ||
CHEMBL179531 | 63034 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 507 | 6 | 1 | 5 | 4.6 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Br | 10.1021/jm049218c | ||
9986320 | 100964 | 6 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1021/jm0205402 | ||
CHEMBL297491 | 100964 | 6 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1021/jm0205402 | ||
9986320 | 100964 | 6 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL297491 | 100964 | 6 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(OC)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL2371555 | 208336 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)N[C@@H](C(=O)N[C@@H]2CC(=O)N[C@H](C(=O)O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCCNC(=O)CC[C@H](NC2=O)C(=O)N[C@H](Cc2ccc4ccccc4c2)C(=O)N[C@@H](CC(C)C)C(=O)N3)CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
10394119 | 113949 | 0 | None | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333345 | 113949 | 0 | None | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44432646 | 146701 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL392843 | 146701 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 581 | 9 | 2 | 3 | 7.0 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCC2CCOCC2)CN(C(=O)Cc2ccccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44587395 | 172059 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 2 | 7 | 5.3 | Cc1c(-c2cccc(OCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL449373 | 172059 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 617 | 11 | 2 | 7 | 5.3 | Cc1c(-c2cccc(OCCCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
10394119 | 113949 | 0 | None | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333345 | 113949 | 0 | None | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
9809382 | 100208 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL292291 | 100208 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 628 | 11 | 2 | 8 | 5.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL216633 | 207589 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CC(=O)NC[C@@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44449683 | 156771 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 517 | 9 | 2 | 7 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL407719 | 156771 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 517 | 9 | 2 | 7 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](CO)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
44577099 | 178165 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 4.4 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1F | 10.1021/jm701249f | ||
CHEMBL468552 | 178165 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 4.4 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1F | 10.1021/jm701249f | ||
9891852 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL261145 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
22716552 | 123253 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 4.4 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL362237 | 123253 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 4.4 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2F)CS3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
9891852 | 10953 | 0 | None | 18 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117736 | 10953 | 0 | None | 18 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
9891852 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL261145 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21045829 | 112899 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4nccc(NCC5CCCO5)n4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331855 | 112899 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4nccc(NCC5CCCO5)n4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
9891852 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL261145 | 95831 | 0 | None | 13 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/j.bmc.2007.09.026 | ||
44352607 | 20450 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 607 | 11 | 0 | 9 | 5.5 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL130855 | 20450 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 607 | 11 | 0 | 9 | 5.5 | COc1ccc(-c2c(C#N)c3n(Cc4ccccc4F)cc(C(=O)OC(C)C)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00779-x | ||
44352678 | 114735 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL334729 | 114735 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2ccc(F)cc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
10908122 | 183691 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 597 | 10 | 0 | 9 | 5.1 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1cccnc1 | 10.1021/jm0205402 | ||
CHEMBL48389 | 183691 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 597 | 10 | 0 | 9 | 5.1 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1cccnc1 | 10.1021/jm0205402 | ||
11027376 | 84805 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 3.9 | Cc1c(-c2ccccc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL22563 | 84805 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 3.9 | Cc1c(-c2ccccc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
11168330 | 98940 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL282707 | 98940 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1021/jm030472z | ||
44353238 | 18351 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 553 | 10 | 0 | 7 | 5.8 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL127502 | 18351 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 553 | 10 | 0 | 7 | 5.8 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
11168330 | 98940 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL282707 | 98940 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11027376 | 84805 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 3.9 | Cc1c(-c2ccccc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL22563 | 84805 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 3.9 | Cc1c(-c2ccccc2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44451399 | 168155 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 1715 | 30 | 6 | 20 | 10.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3cccc(C#CCNC(=O)C4CCN(C(=O)CN(Cc5ccccc5)Cc5c(-c6ccc(NC(=O)NCC)cc6)nc6n(Cc7c(F)cccc7F)cc(C(=O)OCC)c(=O)n56)CC4)c3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL436906 | 168155 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 1715 | 30 | 6 | 20 | 10.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3cccc(C#CCNC(=O)C4CCN(C(=O)CN(Cc5ccccc5)Cc5c(-c6ccc(NC(=O)NCC)cc6)nc6n(Cc7c(F)cccc7F)cc(C(=O)OCC)c(=O)n56)CC4)c3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL2370259 | 208076 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990432o | ||||
44309357 | 97637 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 651 | 13 | 1 | 8 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL273358 | 97637 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 651 | 13 | 1 | 8 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
44390780 | 63163 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 508 | 6 | 1 | 10 | 2.2 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccc3nsnc3c2)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL179953 | 63163 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 508 | 6 | 1 | 10 | 2.2 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccc3nsnc3c2)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
11455317 | 62559 | 0 | None | 851 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL178457 | 62559 | 0 | None | 851 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
44576681 | 192868 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 553 | 11 | 2 | 6 | 4.9 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL526887 | 192868 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 553 | 11 | 2 | 6 | 4.9 | O=C(O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44353271 | 22368 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 580 | 10 | 1 | 7 | 5.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL132616 | 22368 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 580 | 10 | 1 | 7 | 5.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(C)=O)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44394767 | 125682 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 575 | 9 | 2 | 9 | 5.2 | COc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL365001 | 125682 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 575 | 9 | 2 | 9 | 5.2 | COc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
44394894 | 168303 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 548 | 7 | 1 | 7 | 5.3 | Cc1c(-c2csc(-c3ccc(F)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL438201 | 168303 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 548 | 7 | 1 | 7 | 5.3 | Cc1c(-c2csc(-c3ccc(F)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
9873729 | 11266 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 613 | 12 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL117977 | 11266 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 613 | 12 | 0 | 7 | 6.9 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
86276161 | 109365 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 441 | 6 | 1 | 7 | 4.8 | COc1nc(F)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL3233520 | 109365 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 441 | 6 | 1 | 7 | 4.8 | COc1nc(F)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(cc2C)CCC3(C)C)o1 | 10.1016/j.bmcl.2014.02.002 | ||
21047858 | 9993 | 0 | None | 17 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CN)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL115425 | 9993 | 0 | None | 17 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CN)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
9828154 | 63538 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 523 | 10 | 0 | 9 | 2.1 | COc1cccc(-n2c(=O)n(CCN(C)CCc3ccccn3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL180352 | 63538 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 523 | 10 | 0 | 9 | 2.1 | COc1cccc(-n2c(=O)n(CCN(C)CCc3ccccn3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2004.11.026 | ||
44352747 | 21887 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 560 | 10 | 0 | 8 | 5.5 | CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL132179 | 21887 | 0 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 560 | 10 | 0 | 8 | 5.5 | CCOC(=O)c1cn(Cc2ccccc2)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44267905 | 97912 | 0 | None | 13 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275251 | 97912 | 0 | None | 13 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44346348 | 113855 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 8 | 6.1 | C[C@H](N)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL333103 | 113855 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 665 | 10 | 2 | 8 | 6.1 | C[C@H](N)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
11477988 | 90579 | 0 | None | 954 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23969 | 90579 | 0 | None | 954 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
11092567 | 101028 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 5.0 | COCCN(C)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
CHEMBL297938 | 101028 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 5.0 | COCCN(C)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
11103551 | 101208 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCC4CCCCC4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL299320 | 101208 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCC4CCCCC4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44340632 | 9430 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 483 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNC3CCCC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112188 | 9430 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 483 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNC3CCCC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44312806 | 11216 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 3.8 | Cc1ccc(Cn2c(C)c(-c3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL1179388 | 11216 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 3.8 | Cc1ccc(Cn2c(C)c(-c3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL73454 | 11216 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 3.8 | Cc1ccc(Cn2c(C)c(-c3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 | 10.1016/j.bmcl.2004.02.004 | ||
44353247 | 115561 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 608 | 11 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL335610 | 115561 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 608 | 11 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
21047516 | 15173 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 595 | 12 | 3 | 7 | 6.9 | COCCNc1nccc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121412 | 15173 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 595 | 12 | 3 | 7 | 6.9 | COCCNc1nccc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
44353247 | 115561 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 608 | 11 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL335610 | 115561 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 608 | 11 | 1 | 7 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)C(C)C)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/j.bmc.2007.09.026 | ||
44353265 | 22125 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 644 | 17 | 2 | 7 | 6.0 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCN(CC)CC)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL132392 | 22125 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 644 | 17 | 2 | 7 | 6.0 | CCCCNC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(NC(=O)CCC)cc3)c(CN(C)CCN(CC)CC)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
21045834 | 16268 | 0 | None | -3 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4ncccn4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL123301 | 16268 | 0 | None | -3 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CNc4ncccn4)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11250647 | 1516 | 40 | None | -117 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
5293 | 1516 | 40 | None | -117 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
8362 | 1516 | 40 | None | -117 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
CHEMBL1208155 | 1516 | 40 | None | -117 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
DB11979 | 1516 | 40 | None | -117 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.1021/jm8006454 | ||
44451406 | 96134 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 530 | 9 | 0 | 6 | 4.6 | CC(CCN1CCc2c(c(=O)n(CCN3CCCCC3)c(=O)n2Cc2c(F)cccc2F)C1)CC(C)(C)C | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL263118 | 96134 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 530 | 9 | 0 | 6 | 4.6 | CC(CCN1CCc2c(c(=O)n(CCN3CCCCC3)c(=O)n2Cc2c(F)cccc2F)C1)CC(C)(C)C | 10.1016/j.bmc.2007.09.026 | ||
11282957 | 121819 | 0 | None | 1096 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
CHEMBL359894 | 121819 | 0 | None | 1096 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
44436018 | 146532 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 550 | 8 | 1 | 6 | 4.5 | CN[C@@H](Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2)c1ccccc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392709 | 146532 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 550 | 8 | 1 | 6 | 4.5 | CN[C@@H](Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2)c1ccccc1 | 10.1016/j.bmc.2007.05.029 | ||
44353305 | 19624 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 568 | 10 | 0 | 8 | 5.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc([N+](=O)[O-])cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL130195 | 19624 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 568 | 10 | 0 | 8 | 5.7 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc([N+](=O)[O-])cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL405918 | 210839 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CSSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
11261195 | 63375 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL180124 | 63375 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
11261195 | 63375 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL180124 | 63375 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
11386605 | 89763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL23823 | 89763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11786039 | 85354 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 9 | 0 | 6 | 5.0 | Cc1c(-c2ccc3ccccc3c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL22937 | 85354 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 9 | 0 | 6 | 5.0 | Cc1c(-c2ccc3ccccc3c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
11386605 | 89763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23823 | 89763 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44346649 | 113067 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 589 | 7 | 1 | 9 | 4.5 | O=c1c2c(CN3CCNCC3)c(-c3ccc([N+](=O)[O-])cc3)sc2n(Cc2c(F)cccc2F)c(=O)n1-c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL332194 | 113067 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 589 | 7 | 1 | 9 | 4.5 | O=c1c2c(CN3CCNCC3)c(-c3ccc([N+](=O)[O-])cc3)sc2n(Cc2c(F)cccc2F)c(=O)n1-c1ccccc1 | 10.1016/s0960-894x(03)00746-7 | ||
44389571 | 62819 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 4.1 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2)CC3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL178961 | 62819 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 4.1 | COc1cccc(-c2c3n(c(=O)n(C[C@H](N)c4ccccc4)c2=O)C(c2ccccc2)CC3)c1F | 10.1016/j.bmcl.2005.01.009 | ||
44267903 | 161683 | 0 | None | -3 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 906 | 10 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCN(C)C2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL416337 | 161683 | 0 | None | -3 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 906 | 10 | 1 | 13 | 6.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCN(C)C2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44394779 | 66733 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 598 | 7 | 1 | 7 | 6.2 | Cc1c(-c2csc(-c3ccc(C(F)(F)F)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL187243 | 66733 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 598 | 7 | 1 | 7 | 6.2 | Cc1c(-c2csc(-c3ccc(C(F)(F)F)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
44309559 | 102489 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 616 | 9 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL306431 | 102489 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 616 | 9 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44309559 | 102489 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 616 | 9 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL306431 | 102489 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 616 | 9 | 0 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.09.026 | ||
44340656 | 109988 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL324759 | 109988 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44340652 | 9364 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL111820 | 9364 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
11238459 | 89110 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 570 | 9 | 0 | 8 | 4.2 | Cc1c(-c2ccc3c(c2)OC(F)(F)O3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL23737 | 89110 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 570 | 9 | 0 | 8 | 4.2 | Cc1c(-c2ccc3c(c2)OC(F)(F)O3)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
44432645 | 86774 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 487 | 5 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CN)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232752 | 86774 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 487 | 5 | 2 | 2 | 5.6 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CN)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44267906 | 166931 | 0 | None | -9 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL429949 | 166931 | 0 | None | -9 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
10983989 | 199988 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.6 | Cc1c(-c2cccc(O)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL60618 | 199988 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.6 | Cc1c(-c2cccc(O)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44451276 | 95595 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1635 | 32 | 8 | 20 | 9.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@H](C)NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL259878 | 95595 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1635 | 32 | 8 | 20 | 9.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@H](C)NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
11284264 | 84331 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 550 | 11 | 0 | 8 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1OC | 10.1021/jm030472z | ||
CHEMBL22300 | 84331 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 550 | 11 | 0 | 8 | 3.9 | COc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1OC | 10.1021/jm030472z | ||
10907714 | 201471 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 546 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCC[C@@H]3Cc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL64212 | 201471 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 546 | 9 | 0 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCC[C@@H]3Cc3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
11124671 | 201494 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 574 | 10 | 0 | 7 | 4.8 | Cc1c(-c2cccc(OC(F)(F)F)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
CHEMBL64273 | 201494 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 574 | 10 | 0 | 7 | 4.8 | Cc1c(-c2cccc(OC(F)(F)F)c2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm034041s | ||
44394608 | 66728 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 559 | 8 | 2 | 8 | 5.5 | Cc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL187217 | 66728 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 559 | 8 | 2 | 8 | 5.5 | Cc1ccc(Nc2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
44394841 | 165409 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 562 | 7 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL425178 | 165409 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 562 | 7 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL412504 | 211252 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H]1CC(=O)NCC(=O)NC[C@@H]2NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CC(=O)NC[C@@H](C(N)=O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm990116+ | ||||
11124921 | 191204 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 612 | 10 | 1 | 9 | 5.5 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1O | 10.1021/jm0205402 | ||
CHEMBL51983 | 191204 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 612 | 10 | 1 | 9 | 5.5 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1O | 10.1021/jm0205402 | ||
44436010 | 88932 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 599 | 8 | 0 | 7 | 4.8 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(Cc5ccccn5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236967 | 88932 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 599 | 8 | 0 | 7 | 4.8 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(Cc5ccccn5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44352957 | 116232 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 11 | 0 | 10 | 4.8 | CCOC(=O)c1cn(Cc2ccccc2C#N)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL337433 | 116232 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 11 | 0 | 10 | 4.8 | CCOC(=O)c1cn(Cc2ccccc2C#N)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11214860 | 84347 | 0 | None | -323 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
CHEMBL22314 | 84347 | 0 | None | -323 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 541 | 10 | 1 | 7 | 4.8 | CCc1ccc(CN[C@@H](C)Cn2c(=O)c(-c3cccc(OC)c3F)c(C)n(Cc3c(F)cccc3F)c2=O)o1 | 10.1021/jm030472z | ||
11191675 | 63052 | 0 | None | 186 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL179600 | 63052 | 0 | None | 186 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL3085404 | 63052 | 0 | None | 186 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
44340637 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL112466 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2004.07.022 | ||
44340652 | 9364 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL111820 | 9364 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
17757566 | 88114 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 573 | 10 | 0 | 7 | 4.1 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235270 | 88114 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 573 | 10 | 0 | 7 | 4.1 | Cc1ccc(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
17757565 | 146421 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 593 | 10 | 0 | 7 | 4.4 | Cc1cc(Cl)ccc1CN1CCc2c(c(=O)n(CCN(C)CCc3ccccn3)c(=O)n2Cc2c(F)cccc2F)C1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392605 | 146421 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 593 | 10 | 0 | 7 | 4.4 | Cc1cc(Cl)ccc1CN1CCc2c(c(=O)n(CCN(C)CCc3ccccn3)c(=O)n2Cc2c(F)cccc2F)C1 | 10.1016/j.bmc.2007.05.029 | ||
44387972 | 63545 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 514 | 7 | 1 | 8 | 2.8 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL180372 | 63545 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 514 | 7 | 1 | 8 | 2.8 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
11214294 | 121681 | 0 | None | 912 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL359754 | 121681 | 0 | None | 912 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
44340749 | 108631 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL321376 | 108631 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
9829468 | 188181 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 567 | 9 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL50546 | 188181 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 567 | 9 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44340749 | 108631 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL321376 | 108631 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
9829468 | 188181 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 567 | 9 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccn4)n3c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL50546 | 188181 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 567 | 9 | 0 | 7 | 6.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)CCc4ccccn4)n3c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL2371542 | 208334 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)CCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm9901172 | ||||
44434414 | 88098 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 709 | 14 | 3 | 9 | 4.6 | C#CCNC(=O)CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCC)cc2)nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL235179 | 88098 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 709 | 14 | 3 | 9 | 4.6 | C#CCNC(=O)CN(Cc1ccccc1)Cc1c(-c2ccc(NC(=O)NCC)cc2)nc2n(Cc3c(F)cccc3F)cc(C(=O)OCC)c(=O)n12 | 10.1016/j.bmc.2007.04.065 | ||
44267906 | 166931 | 0 | None | 9 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL429949 | 166931 | 0 | None | 9 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44399944 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL191817 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44399944 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
44399944 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL191817 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL191817 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2008.04.036 | ||
44399944 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL191817 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44340637 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112466 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44340637 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
CHEMBL112466 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1021/jm701249f | ||
44340637 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL112466 | 9488 | 0 | None | 1479 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 520 | 9 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N(C)Cc3ccccn3)c2=O)c1 | 10.1016/j.bmcl.2005.01.009 | ||
11156980 | 62264 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 505 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL178281 | 62264 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 505 | 7 | 1 | 7 | 4.0 | CN[C@@H](Cn1c(=O)c(-c2ccc3c(c2)OCO3)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
11374717 | 121781 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL359810 | 121781 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL419270 | 121781 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
44399944 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL191817 | 68293 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
44432639 | 86535 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 536 | 10 | 2 | 4 | 5.8 | COc1ccccc1CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL232356 | 86535 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 536 | 10 | 2 | 4 | 5.8 | COc1ccccc1CC(=O)N1CCc2[nH]c(-c3cc(C)cc(C)c3)c([C@H](C)CNCCc3ccncc3)c2C1 | 10.1016/j.bmcl.2007.05.009 | ||
44267887 | 98029 | 0 | None | -41 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 967 | 10 | 1 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275935 | 98029 | 0 | None | -41 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 967 | 10 | 1 | 14 | 7.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL414275 | 211371 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CSSC[C@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc3ccc4ccccc4c3)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44353249 | 167881 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 659 | 17 | 1 | 8 | 6.8 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCN(CC)CC)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL434995 | 167881 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 659 | 17 | 1 | 8 | 6.8 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCN(CC)CC)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
10051739 | 85008 | 0 | None | 501 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL22653 | 85008 | 0 | None | 501 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
44451350 | 95709 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 4.5 | CNC(Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C)cc1C)C2)c1ccccc1 | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL260552 | 95709 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 544 | 8 | 1 | 6 | 4.5 | CNC(Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(C)cc1C)C2)c1ccccc1 | 10.1016/j.bmc.2007.09.026 | ||
9939030 | 155187 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 623 | 11 | 1 | 6 | 7.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2cc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)cc2c1=O | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL405449 | 155187 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 623 | 11 | 1 | 6 | 7.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2cc(-c3ccc(NC(=O)CC)cc3)c(CN(C)Cc3ccccc3)cc2c1=O | 10.1016/j.bmc.2007.09.026 | ||
44267882 | 166031 | 0 | None | 12 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 876 | 11 | 1 | 12 | 7.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL428008 | 166031 | 0 | None | 12 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 876 | 11 | 1 | 12 | 7.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
14557580 | 88940 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 972 | 26 | 11 | 11 | 0.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cccc2ccccc12 | 10.1021/jm00130a019 | ||
CHEMBL2369785 | 88940 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 972 | 26 | 11 | 11 | 0.3 | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cccc2ccccc12 | 10.1021/jm00130a019 | ||
9916573 | 156513 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 593 | 11 | 0 | 9 | 5.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL407399 | 156513 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 593 | 11 | 0 | 9 | 5.1 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44394578 | 129649 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 586 | 7 | 1 | 7 | 6.4 | Cc1c(-c2csc(-c3ccc(C(C)(C)C)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL367806 | 129649 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 586 | 7 | 1 | 7 | 6.4 | Cc1c(-c2csc(-c3ccc(C(C)(C)C)cc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
11752557 | 63368 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL180117 | 63368 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL74925 | 63368 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1016/j.bmcl.2004.02.004 | ||
44451498 | 155081 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1700 | 30 | 7 | 19 | 9.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)N2CCC(C(=O)NCC#Cc3ccccc3C#CCNC(=O)C3CCN(C(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)CC3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL404611 | 155081 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1700 | 30 | 7 | 19 | 9.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)N2CCC(C(=O)NCC#Cc3ccccc3C#CCNC(=O)C3CCN(C(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)CC3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL2370249 | 208070 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
11202795 | 112335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL330804 | 112335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11477970 | 89069 | 0 | None | 281 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL23729 | 89069 | 0 | None | 281 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
11202795 | 112335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL330804 | 112335 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C(C)C)c2=O)c1F | 10.1021/jm049791w | ||
21046387 | 110163 | 0 | None | 53 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 6.6 | CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL325843 | 110163 | 0 | None | 53 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 6.6 | CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
44267875 | 15394 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 879 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL12204 | 15394 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 879 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44451391 | 168298 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1715 | 30 | 6 | 20 | 10.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccc(C#CCNC(=O)C4CCN(C(=O)CN(Cc5ccccc5)Cc5c(-c6ccc(NC(=O)NCC)cc6)nc6n(Cc7c(F)cccc7F)cc(C(=O)OCC)c(=O)n56)CC4)cc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL438168 | 168298 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1715 | 30 | 6 | 20 | 10.7 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC(C(=O)NCC#Cc3ccc(C#CCNC(=O)C4CCN(C(=O)CN(Cc5ccccc5)Cc5c(-c6ccc(NC(=O)NCC)cc6)nc6n(Cc7c(F)cccc7F)cc(C(=O)OCC)c(=O)n56)CC4)cc3)CC2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21046569 | 11903 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 594 | 9 | 2 | 7 | 7.0 | COC(=O)c1cc(C)nc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL118330 | 11903 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 594 | 9 | 2 | 7 | 7.0 | COC(=O)c1cc(C)nc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)n1 | 10.1016/s0960-894x(02)00756-4 | ||
21045818 | 112597 | 0 | None | -3 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncccn4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331337 | 112597 | 0 | None | -3 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 522 | 8 | 2 | 5 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncccn4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11050500 | 101378 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 636 | 9 | 0 | 8 | 6.5 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCC(c2ccccc2)CC1 | 10.1021/jm0205402 | ||
CHEMBL300484 | 101378 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 636 | 9 | 0 | 8 | 6.5 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCC(c2ccccc2)CC1 | 10.1021/jm0205402 | ||
44435828 | 88677 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 598 | 11 | 1 | 7 | 4.0 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(CCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236546 | 88677 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 598 | 11 | 1 | 7 | 4.0 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(CCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2007.05.029 | ||
44309631 | 102136 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 652 | 14 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2cccnc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL304156 | 102136 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 652 | 14 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)Cc2cccnc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44587397 | 171787 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 589 | 9 | 2 | 7 | 4.5 | Cc1c(-c2cccc(OCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL447592 | 171787 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 589 | 9 | 2 | 7 | 4.5 | Cc1c(-c2cccc(OCC(=O)O)c2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
9891852 | 95831 | 0 | None | -13 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL261145 | 95831 | 0 | None | -13 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 492 | 7 | 4 | 3 | 5.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44436000 | 146669 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 576 | 7 | 0 | 6 | 5.3 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4C4CCCC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392815 | 146669 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 576 | 7 | 0 | 6 | 5.3 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4C4CCCC4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
21045831 | 10395 | 0 | None | -7 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 422 | 5 | 2 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCNCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116611 | 10395 | 0 | None | -7 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 422 | 5 | 2 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCNCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
21047815 | 14779 | 0 | None | -30 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120834 | 14779 | 0 | None | -30 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(Cl)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44340646 | 9597 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL113059 | 9597 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 506 | 9 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11421385 | 167857 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1021/jm049218c | ||
CHEMBL433302 | 167857 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1021/jm049218c | ||
CHEMBL434906 | 167857 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1021/jm049218c | ||
11049737 | 101892 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCCC3c3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
CHEMBL303811 | 101892 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN3CCCC3c3ccccn3)c2=O)c1 | 10.1021/jm034041s | ||
44451345 | 96063 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1607 | 32 | 8 | 20 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccc(C#CCNC(=O)CNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL262599 | 96063 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1607 | 32 | 8 | 20 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCC(=O)NCC#Cc2ccc(C#CCNC(=O)CNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44451474 | 168192 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1635 | 32 | 8 | 20 | 9.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@H](C)NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL437260 | 168192 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1635 | 32 | 8 | 20 | 9.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@@H](C)C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@H](C)NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21048462 | 109828 | 0 | None | 60 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 522 | 5 | 1 | 4 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL323863 | 109828 | 0 | None | 60 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 522 | 5 | 1 | 4 | 6.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44433200 | 149651 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 555 | 7 | 0 | 8 | 4.1 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccc(-n4ccnc4)cc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL395183 | 149651 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 555 | 7 | 0 | 8 | 4.1 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccc(-n4ccnc4)cc2)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL415608 | 211447 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44343931 | 109912 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 568 | 11 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL324375 | 109912 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 568 | 11 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
9910626 | 10290 | 0 | None | 1 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.6 | Cc1cnc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cn1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116246 | 10290 | 0 | None | 1 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.6 | Cc1cnc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cn1 | 10.1016/s0960-894x(02)00755-2 | ||
44343931 | 109912 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 568 | 11 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL324375 | 109912 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 568 | 11 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
44400195 | 69045 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL193089 | 69045 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 531 | 7 | 1 | 6 | 4.7 | COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
21047519 | 14301 | 0 | None | -1 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 6.8 | Cc1cc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc(N)n1 | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120048 | 14301 | 0 | None | -1 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 551 | 8 | 3 | 6 | 6.8 | Cc1cc(NCc2cccc(CNC(=O)c3ccc(Cc4cc5c(cc4C)C(C)(C)CCC5(C)C)o3)c2)nc(N)n1 | 10.1016/s0960-894x(02)00756-4 | ||
44340697 | 110180 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 492 | 9 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL325942 | 110180 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 492 | 9 | 1 | 7 | 3.5 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCNCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
44340612 | 9487 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112461 | 9487 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNCc3ccccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11477970 | 89069 | 0 | None | 281 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23729 | 89069 | 0 | None | 281 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3ccccc3)c2=O)c1F | 10.1021/jm030472z | ||
44309359 | 101856 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 619 | 10 | 1 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(S)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL303621 | 101856 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 619 | 10 | 1 | 8 | 6.7 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(S)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
9910626 | 10290 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.6 | Cc1cnc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cn1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116246 | 10290 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.6 | Cc1cnc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cn1 | 10.1016/s0960-894x(02)00755-2 | ||
44347048 | 14344 | 0 | None | -18 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120164 | 14344 | 0 | None | -18 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
9911446 | 10681 | 0 | None | -33 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(C#N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117170 | 10681 | 0 | None | -33 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 446 | 5 | 1 | 3 | 6.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(C#N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44267864 | 167195 | 0 | None | -30 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CCC1CN(C(=O)O[C@H]2[C@H](C)[C@@H](OC3O[C@H](C)C[C@H](N(C)C(C)C)[C@H]3O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]3N(CCc4ccc(Cl)cc4)C(=O)O[C@]3(C)[C@@H](CC)OC(=O)[C@@H]2C)C(=O)O1 | 10.1021/jm030418i | ||
CHEMBL430312 | 167195 | 0 | None | -30 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CCC1CN(C(=O)O[C@H]2[C@H](C)[C@@H](OC3O[C@H](C)C[C@H](N(C)C(C)C)[C@H]3O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]3N(CCc4ccc(Cl)cc4)C(=O)O[C@]3(C)[C@@H](CC)OC(=O)[C@@H]2C)C(=O)O1 | 10.1021/jm030418i | ||
44267905 | 97912 | 0 | None | -13 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275251 | 97912 | 0 | None | -13 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11421385 | 167857 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL433302 | 167857 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL434906 | 167857 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 429 | 6 | 1 | 5 | 3.9 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 | 10.1016/j.bmcl.2004.02.004 | ||
44347005 | 113966 | 0 | None | -6 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 613 | 10 | 3 | 7 | 7.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(Nc4nccc(NCC5CCCO5)n4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333461 | 113966 | 0 | None | -6 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 613 | 10 | 3 | 7 | 7.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(Nc4nccc(NCC5CCCO5)n4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11752557 | 63368 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1021/jm049218c | ||
CHEMBL180117 | 63368 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1021/jm049218c | ||
CHEMBL74925 | 63368 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 395 | 6 | 1 | 5 | 3.5 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC(C)C | 10.1021/jm049218c | ||
44399956 | 123527 | 1 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL363094 | 123527 | 1 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 481 | 7 | 1 | 6 | 3.9 | COc1cccc(-c2cn(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44346239 | 14342 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 707 | 12 | 2 | 8 | 7.2 | CC(C)C[C@H](N)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL120149 | 14342 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 707 | 12 | 2 | 8 | 7.2 | CC(C)C[C@H](N)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
44434436 | 150440 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1619 | 39 | 6 | 26 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL395825 | 150440 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1619 | 39 | 6 | 26 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44577100 | 177917 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 452 | 6 | 1 | 6 | 3.1 | N[C@@H](Cn1c(=O)c(Cc2c(F)cccc2F)nn(-c2ccccc2F)c1=O)c1ccccc1 | 10.1021/jm701249f | ||
CHEMBL466541 | 177917 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 452 | 6 | 1 | 6 | 3.1 | N[C@@H](Cn1c(=O)c(Cc2c(F)cccc2F)nn(-c2ccccc2F)c1=O)c1ccccc1 | 10.1021/jm701249f | ||
44451356 | 95916 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 870 | 18 | 4 | 10 | 5.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL261649 | 95916 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 870 | 18 | 4 | 10 | 5.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44387909 | 122252 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 495 | 8 | 1 | 9 | 2.0 | COc1cccc(-n2c(=O)n(CCC(N)c3cccnc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL360472 | 122252 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 495 | 8 | 1 | 9 | 2.0 | COc1cccc(-n2c(=O)n(CCC(N)c3cccnc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
9960268 | 188400 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 596 | 10 | 0 | 8 | 5.8 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1 | 10.1021/jm0205402 | ||
CHEMBL50856 | 188400 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 596 | 10 | 0 | 8 | 5.8 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN(C)Cc1ccccc1 | 10.1021/jm0205402 | ||
44340844 | 110064 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 9 | 0 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)CC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL325233 | 110064 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 9 | 0 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CN(C)CC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11751752 | 13451 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 2.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119391 | 13451 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 2.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1F | 10.1021/jm049791w | ||
11374717 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL359810 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
CHEMBL419270 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm701249f | ||
44400230 | 68342 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL192172 | 68342 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
1179 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
9957278 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
CHEMBL494803 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1016/j.bmcl.2014.02.002 | ||
44400230 | 68342 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL192172 | 68342 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 4.4 | N[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
11374717 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL359810 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL419270 | 121781 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 6 | 1 | 5 | 4.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.02.004 | ||
1179 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
9957278 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
CHEMBL494803 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 10.1039/C7MD00320J | ||
21045805 | 13672 | 0 | None | 5 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL119546 | 13672 | 0 | None | 5 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44215933 | 95632 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3nccs3)c2=O)c1F | 10.1016/j.bmc.2007.09.026 | ||
CHEMBL260062 | 95632 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCc3nccs3)c2=O)c1F | 10.1016/j.bmc.2007.09.026 | ||
44432655 | 148954 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 675 | 11 | 3 | 6 | 6.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCOc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL394634 | 148954 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 675 | 11 | 3 | 6 | 6.5 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCOc2ccc(-c4nnn[nH]4)cc2)CN(C(=O)Cc2c(F)cccc2C(F)(F)F)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44400354 | 132983 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 559 | 8 | 1 | 6 | 5.5 | CC(C)Oc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL370711 | 132983 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 559 | 8 | 1 | 6 | 5.5 | CC(C)Oc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44267865 | 160837 | 0 | None | 10 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CC[C@H]1COC(=O)N1C(=O)O[C@H]1[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@@H]1C | 10.1021/jm030418i | ||
CHEMBL412634 | 160837 | 0 | None | 10 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CC[C@H]1COC(=O)N1C(=O)O[C@H]1[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@@H]1C | 10.1021/jm030418i | ||
11236870 | 10943 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL117670 | 10943 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11294792 | 62958 | 0 | None | 380 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL179269 | 62958 | 0 | None | 380 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
10345138 | 122042 | 0 | None | 2041 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL360143 | 122042 | 0 | None | 2041 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
CHEMBL75347 | 122042 | 0 | None | 2041 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 481 | 6 | 1 | 5 | 4.7 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl | 10.1021/jm049218c | ||
11236870 | 10943 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL117670 | 10943 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 8 | 1 | 6 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)C)c2=O)c1F | 10.1021/jm049791w | ||
11226753 | 63014 | 0 | None | 389 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL179429 | 63014 | 0 | None | 389 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 523 | 8 | 0 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](c3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11180219 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL326504 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049218c | ||
11180219 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL326504 | 110733 | 0 | None | 112 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 501 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)C3CCCCC3)c2=O)c1F | 10.1021/jm049791w | ||
9823968 | 109992 | 0 | None | 1 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 2 | 6.8 | Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL324771 | 109992 | 0 | None | 1 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 2 | 6.8 | Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1 | 10.1016/s0960-894x(02)00755-2 | ||
1184 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
9874838 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL71917 | 3676 | 31 | None | -426 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 657 | 11 | 1 | 7 | 7.8 | CC(OC(=O)c1cn(Cc2c(F)cccc2F)c2c(c1=O)c(CN(Cc1ccccc1)C)c(s2)c1ccc(cc1)NC(=O)C(C)C)C | 10.1016/s0960-894x(03)00746-7 | ||
11751752 | 13451 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 2.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL119391 | 13451 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 2.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)N)c2=O)c1F | 10.1021/jm049218c | ||
44436011 | 88067 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 613 | 9 | 0 | 7 | 4.9 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(CCc5ccccn5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235046 | 88067 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 613 | 9 | 0 | 7 | 4.9 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCN(CCc5ccccn5)C4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44451447 | 156133 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1663 | 36 | 8 | 20 | 10.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccc(C#CCNC(=O)CCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL406960 | 156133 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1663 | 36 | 8 | 20 | 10.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccc(C#CCNC(=O)CCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44352949 | 115581 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL335650 | 115581 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 611 | 11 | 0 | 9 | 5.2 | CCOC(=O)c1cn(Cc2cc(F)ccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11444384 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1021/jm049218c | ||
CHEMBL179663 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1021/jm049218c | ||
CHEMBL311380 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1021/jm049218c | ||
44449120 | 94789 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL256109 | 94789 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 567 | 8 | 1 | 6 | 5.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1Cl | 10.1016/j.bmcl.2008.04.029 | ||
44346666 | 112340 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 622 | 9 | 0 | 7 | 6.9 | CN(Cc1ccccc1)Cc1c(-c2ccc(N(C)C)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL330835 | 112340 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 622 | 9 | 0 | 7 | 6.9 | CN(Cc1ccccc1)Cc1c(-c2ccc(N(C)C)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
9958318 | 89796 | 0 | None | 15 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23830 | 89796 | 0 | None | 15 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 520 | 10 | 0 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
11167850 | 2701 | 22 | None | -6309 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1178 | 2701 | 22 | None | -6309 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
1187 | 2701 | 22 | None | -6309 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
CHEMBL179691 | 2701 | 22 | None | -6309 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 10.1021/jm8006454 | ||
CHEMBL216930 | 207601 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44353231 | 116309 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 595 | 12 | 0 | 7 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL337865 | 116309 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 595 | 12 | 0 | 7 | 6.9 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2cc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(01)00780-6 | ||
44451420 | 95766 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1719 | 40 | 8 | 20 | 11.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccc(C#CCNC(=O)CCCCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL260812 | 95766 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1719 | 40 | 8 | 20 | 11.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccc(C#CCNC(=O)CCCCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44387883 | 62944 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 478 | 8 | 1 | 8 | 2.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)CC(C)C)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL179212 | 62944 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 478 | 8 | 1 | 8 | 2.0 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(CC(N)CC(C)C)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
11341990 | 62171 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1021/jm049218c | ||
CHEMBL178127 | 62171 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1021/jm049218c | ||
CHEMBL76277 | 62171 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1021/jm049218c | ||
21047807 | 112487 | 0 | None | 23 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 568 | 8 | 3 | 7 | 6.4 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncc(C#N)c(N)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL331087 | 112487 | 0 | None | 23 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 568 | 8 | 3 | 7 | 6.4 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4ncc(C#N)c(N)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44353284 | 167824 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 652 | 15 | 2 | 8 | 5.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCOC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL434621 | 167824 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 652 | 15 | 2 | 8 | 5.1 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NCCOC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
44388009 | 128162 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 512 | 7 | 1 | 8 | 2.9 | COc1cccc(-n2c(=O)n(C[C@H](N)c3ccccc3)c(=O)n(C(C)c3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL366883 | 128162 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 512 | 7 | 1 | 8 | 2.9 | COc1cccc(-n2c(=O)n(C[C@H](N)c3ccccc3)c(=O)n(C(C)c3c(F)cccc3F)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44267882 | 166031 | 0 | None | -12 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 876 | 11 | 1 | 12 | 7.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL428008 | 166031 | 0 | None | -12 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 876 | 11 | 1 | 12 | 7.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)C2CCCC2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11238091 | 62177 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1021/jm049218c | ||
CHEMBL178142 | 62177 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1021/jm049218c | ||
CHEMBL311407 | 62177 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1021/jm049218c | ||
44353263 | 22048 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 634 | 10 | 0 | 9 | 6.9 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)cc2n(Cc3ccccc3F)cc(-c3nc(C(C)(C)C)co3)c(=O)n12 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL132338 | 22048 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 634 | 10 | 0 | 9 | 6.9 | CN(CCc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)cc2n(Cc3ccccc3F)cc(-c3nc(C(C)(C)C)co3)c(=O)n12 | 10.1016/s0960-894x(01)00780-6 | ||
44346594 | 15398 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 548 | 7 | 0 | 8 | 5.2 | CN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL122064 | 15398 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 548 | 7 | 0 | 8 | 5.2 | CN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44295109 | 101211 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 530 | 8 | 1 | 6 | 6.2 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCC4CCCC4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL299335 | 101211 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 530 | 8 | 1 | 6 | 6.2 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CNCC4CCCC4)n3c2=O)c1 | 10.1021/jm0205402 | ||
11477988 | 90579 | 0 | None | -954 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL23969 | 90579 | 0 | None | -954 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 524 | 9 | 1 | 7 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3ccccn3)c2=O)c1F | 10.1021/jm030472z | ||
11294792 | 62958 | 0 | None | 380 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL179269 | 62958 | 0 | None | 380 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
44309652 | 202602 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccccc4OC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL71400 | 202602 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 617 | 11 | 0 | 8 | 6.4 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccccc4OC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
11192019 | 13149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL119149 | 13149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049218c | ||
44576678 | 170481 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 617 | 11 | 1 | 7 | 5.8 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL445691 | 170481 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 617 | 11 | 1 | 7 | 5.8 | COC(=O)CCCN[C@@H](Cn1c(=O)c(-c2ccccc2Cl)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
11192019 | 13149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119149 | 13149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 509 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)Cc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
44387888 | 60162 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3cccc(F)c3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175491 | 60162 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3cccc(F)c3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
44388033 | 61433 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 497 | 7 | 1 | 9 | 2.1 | COc1cccc(-n2c(=O)n(Cc3cccnc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL177182 | 61433 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 497 | 7 | 1 | 9 | 2.1 | COc1cccc(-n2c(=O)n(Cc3cccnc3Cl)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21045823 | 113643 | 0 | None | 40 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=O)C(F)(F)F)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL332923 | 113643 | 0 | None | 40 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 546 | 7 | 2 | 3 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNC(=O)C(F)(F)F)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44267865 | 160837 | 0 | None | -10 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CC[C@H]1COC(=O)N1C(=O)O[C@H]1[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@@H]1C | 10.1021/jm030418i | ||
CHEMBL412634 | 160837 | 0 | None | -10 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 921 | 11 | 1 | 14 | 7.0 | CC[C@H]1COC(=O)N1C(=O)O[C@H]1[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]2(C)[C@@H](CC)OC(=O)[C@@H]1C | 10.1021/jm030418i | ||
44400122 | 132840 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 467 | 6 | 2 | 6 | 3.5 | N[C@@H](Cn1c(=O)c(-c2cccc(O)c2F)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL370480 | 132840 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 467 | 6 | 2 | 6 | 3.5 | N[C@@H](Cn1c(=O)c(-c2cccc(O)c2F)cn(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
44432637 | 154433 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 492 | 8 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)c2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
CHEMBL401225 | 154433 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 492 | 8 | 2 | 3 | 5.8 | Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CN(C(=O)c2ccccc2)CC3)c1 | 10.1016/j.bmcl.2007.05.009 | ||
44352641 | 117660 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 605 | 12 | 0 | 10 | 5.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL340856 | 117660 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 605 | 12 | 0 | 10 | 5.0 | CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL263690 | 208841 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H]1CC(=O)NC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cccnc2)NC1=O | 10.1021/jm990116+ | ||||
11444384 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL179663 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL311380 | 63089 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 | 10.1016/j.bmcl.2004.02.004 | ||
44309404 | 102276 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 648 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccc2F)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL305034 | 102276 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 648 | 10 | 0 | 8 | 6.9 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN(C)CCc2ccccc2F)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
21045817 | 114052 | 0 | None | 22 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNc4ncccn4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333730 | 114052 | 0 | None | 22 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 528 | 8 | 2 | 5 | 7.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CNc4ncccn4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44448860 | 94621 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL255242 | 94621 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NC3CCCC3)c2=O)c1F | 10.1016/j.bmcl.2008.04.029 | ||
11295556 | 98793 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.3 | CCOc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
CHEMBL281776 | 98793 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 11 | 0 | 7 | 4.3 | CCOc1ccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)CCc3ccccn3)c2=O)cc1 | 10.1021/jm030472z | ||
44576642 | 187211 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 513 | 7 | 2 | 6 | 4.1 | N[C@@H](Cn1c(=O)c(-c2ccc(CO)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL495882 | 187211 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 513 | 7 | 2 | 6 | 4.1 | N[C@@H](Cn1c(=O)c(-c2ccc(CO)cc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44434437 | 150441 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1663 | 42 | 6 | 27 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
CHEMBL395826 | 150441 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1663 | 42 | 6 | 27 | 8.5 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCc2cn(CCOCCOCCOCCn3cc(CNC(=O)CN(Cc4ccccc4)Cc4c(-c5ccc(NC(=O)NCC)cc5)nc5n(Cc6c(F)cccc6F)cc(C(=O)OCC)c(=O)n45)nn3)nn2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2007.04.065 | ||
44267863 | 98066 | 0 | None | -2 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 950 | 12 | 1 | 14 | 7.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL276217 | 98066 | 0 | None | -2 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 950 | 12 | 1 | 14 | 7.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@H]2CC(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11353175 | 99020 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 537 | 9 | 1 | 6 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL283170 | 99020 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 537 | 9 | 1 | 6 | 5.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1F | 10.1021/jm030472z | ||
44394616 | 66026 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 617 | 9 | 2 | 9 | 5.7 | CCOC(=O)Nc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL185143 | 66026 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 617 | 9 | 2 | 9 | 5.7 | CCOC(=O)Nc1ccc(-c2nc(-c3c(C)n(Cc4c(F)cccc4F)c(=O)n(C[C@H](N)c4ccccc4)c3=O)cs2)cc1 | 10.1016/j.bmcl.2004.07.022 | ||
21047618 | 114032 | 0 | None | 1 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 635 | 11 | 3 | 7 | 7.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(C)c(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333574 | 114032 | 0 | None | 1 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 635 | 11 | 3 | 7 | 7.8 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ncc(C)c(NCC5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44288082 | 162618 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 981 | 10 | 1 | 14 | 8.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL418067 | 162618 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 981 | 10 | 1 | 14 | 8.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44449153 | 154537 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 581 | 9 | 1 | 6 | 6.2 | CC[C@H](Cn1c(=O)c(-c2cccc(OC)c2Cl)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
CHEMBL401807 | 154537 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 581 | 9 | 1 | 6 | 6.2 | CC[C@H](Cn1c(=O)c(-c2cccc(OC)c2Cl)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)NC1CCCC1 | 10.1016/j.bmcl.2008.04.029 | ||
10439419 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL302769 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
10439419 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1021/jm701249f | ||
CHEMBL302769 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1021/jm701249f | ||
11477615 | 121630 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 503 | 9 | 0 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](CC(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL359682 | 121630 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 503 | 9 | 0 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](CC(C)C)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
10439419 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL302769 | 101713 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 666 | 15 | 1 | 9 | 6.5 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OC(CC)CC)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44587394 | 171906 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 5.1 | Cc1c(-c2cccc(OCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL448253 | 171906 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 5.1 | Cc1c(-c2cccc(OCCCC(=O)O)c2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1C(F)(F)F | 10.1016/j.bmcl.2008.07.059 | ||
21047583 | 15128 | 0 | None | 10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 607 | 9 | 2 | 7 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(N5CCOCC5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121367 | 15128 | 0 | None | 10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 607 | 9 | 2 | 7 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(N5CCOCC5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44288073 | 168860 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 965 | 12 | 2 | 14 | 7.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL442482 | 168860 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 965 | 12 | 2 | 14 | 7.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C3CCCC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
25156669 | 188541 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 5.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL510538 | 188541 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 645 | 13 | 2 | 7 | 5.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCCCCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
44400121 | 126896 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 483 | 6 | 1 | 5 | 4.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL365985 | 126896 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 483 | 6 | 1 | 5 | 4.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.04.036 | ||
44400121 | 126896 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 483 | 6 | 1 | 5 | 4.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL365985 | 126896 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 483 | 6 | 1 | 5 | 4.6 | N[C@@H](Cn1c(=O)c(-c2ccccc2)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
11050145 | 192764 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 581 | 10 | 0 | 7 | 6.4 | CCN(CCc1ccccn1)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
CHEMBL52506 | 192764 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 581 | 10 | 0 | 7 | 6.4 | CCN(CCc1ccccn1)Cc1c(C(C)(C)C)nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n12 | 10.1021/jm0205402 | ||
11387100 | 10141 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 537 | 9 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](Cc3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL116074 | 10141 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 537 | 9 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](Cc3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049218c | ||
11387100 | 10141 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 537 | 9 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](Cc3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL116074 | 10141 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 537 | 9 | 0 | 6 | 4.6 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](Cc3ccccc3)N(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44267866 | 96665 | 0 | None | 4 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CC(C)OC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL267568 | 96665 | 0 | None | 4 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 907 | 10 | 1 | 14 | 6.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CC(C)OC2=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11179922 | 86892 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23321 | 86892 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1021/jm030472z | ||
44394896 | 65973 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 545 | 8 | 2 | 8 | 5.2 | Cc1c(-c2csc(Nc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL184855 | 65973 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 545 | 8 | 2 | 8 | 5.2 | Cc1c(-c2csc(Nc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
11179922 | 86892 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23321 | 86892 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 519 | 9 | 1 | 6 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3C)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44436019 | 167088 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 564 | 8 | 0 | 6 | 4.9 | CN(C)[C@@H](Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2)c1ccccc1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL430171 | 167088 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 564 | 8 | 0 | 6 | 4.9 | CN(C)[C@@H](Cn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(Cl)cc1)C2)c1ccccc1 | 10.1016/j.bmc.2007.05.029 | ||
44387945 | 122201 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 494 | 8 | 1 | 8 | 2.6 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL360447 | 122201 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 494 | 8 | 1 | 8 | 2.6 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
11157017 | 121874 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL360056 | 121874 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL72199 | 121874 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1016/j.bmcl.2004.02.004 | ||
20728209 | 122807 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 443 | 5 | 1 | 6 | 3.5 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CO2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL361619 | 122807 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 443 | 5 | 1 | 6 | 3.5 | NC(Cn1c(=O)c(-c2ccccc2F)c2n(c1=O)C(c1ccccc1)CO2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
44451294 | 95670 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1647 | 38 | 8 | 18 | 11.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CCCCCNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL260318 | 95670 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 1647 | 38 | 8 | 18 | 11.4 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CCCCCNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21045831 | 10395 | 0 | None | 7 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 422 | 5 | 2 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCNCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL116611 | 10395 | 0 | None | 7 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 422 | 5 | 2 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCNCC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL2370251 | 208071 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
CHEMBL329695 | 209573 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]([C@@H](C)CC)NC1=O | 10.1021/jm990432o | ||||
44340860 | 9524 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 483 | 9 | 0 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)CC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112625 | 9524 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 483 | 9 | 0 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CN(C)CC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11363829 | 10080 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 489 | 7 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL115965 | 10080 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 489 | 7 | 1 | 6 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)CC(C)(C)C)c2=O)c1F | 10.1021/jm049791w | ||
25156399 | 188461 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 603 | 10 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
CHEMBL509440 | 188461 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 603 | 10 | 2 | 7 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](NCC(=O)O)c3ccccc3)c2=O)c1F | 10.1021/jm8006454 | ||
9915597 | 183608 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 552 | 8 | 0 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)Cc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL48316 | 183608 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 552 | 8 | 0 | 6 | 6.6 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)C)c(CN(C)Cc4ccccc4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44340840 | 112825 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1ccc(CNC[C@@H](C)n2c(=O)c(-c3cccc(OC)c3)c(C)n(Cc3c(F)cccc3F)c2=O)cc1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL331592 | 112825 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 535 | 10 | 1 | 7 | 4.7 | COc1ccc(CNC[C@@H](C)n2c(=O)c(-c3cccc(OC)c3)c(C)n(Cc3c(F)cccc3F)c2=O)cc1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL405420 | 210812 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
44451486 | 157632 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1691 | 34 | 8 | 20 | 10.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@@H](NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)C(C)C)cc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL408760 | 157632 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1691 | 34 | 8 | 20 | 10.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@@H](NC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)C(C)C)cc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44388026 | 129296 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.6 | COc1cccc(-n2c(=O)n(Cc3c(Cl)cccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL367548 | 129296 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.6 | COc1cccc(-n2c(=O)n(Cc3c(Cl)cccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21047858 | 9993 | 0 | None | -17 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CN)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL115425 | 9993 | 0 | None | -17 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CN)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
9891852 | 10953 | 0 | None | -18 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117736 | 10953 | 0 | None | -18 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 492 | 7 | 3 | 3 | 5.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NC[C@H]3CC[C@@H](CN=C(N)N)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
10439527 | 168913 | 0 | None | -288 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 677 | 15 | 0 | 9 | 7.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL443027 | 168913 | 0 | None | -288 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 677 | 15 | 0 | 9 | 7.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11214294 | 121681 | 0 | None | 912 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL359754 | 121681 | 0 | None | 912 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 6 | 1 | 7 | 3.8 | Cc1c(-c2ccc3c(c2)OCCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
21045828 | 14395 | 0 | None | -2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(NCC5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL120420 | 14395 | 0 | None | -2 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 7.6 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNc4nccc(NCC5CCCO5)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44451408 | 95749 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1687 | 30 | 6 | 20 | 10.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@@H]3CCCN3C(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL260750 | 95749 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1687 | 30 | 6 | 20 | 10.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccc(C#CCNC(=O)[C@@H]3CCCN3C(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)cc2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
11214295 | 86562 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23237 | 86562 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3)c2=O)c1 | 10.1021/jm030472z | ||
11214295 | 86562 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL23237 | 86562 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 505 | 9 | 1 | 6 | 4.7 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
11341990 | 62171 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL178127 | 62171 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL76277 | 62171 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 447 | 6 | 1 | 5 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 | 10.1016/j.bmcl.2004.02.004 | ||
44387898 | 60719 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 508 | 8 | 1 | 8 | 2.9 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3C)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL176284 | 60719 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 508 | 8 | 1 | 8 | 2.9 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3C)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
10051739 | 85008 | 0 | None | -501 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL22653 | 85008 | 0 | None | -501 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 501 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCCC3)c2=O)c1F | 10.1021/jm030472z | ||
44346662 | 113927 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 633 | 12 | 0 | 9 | 5.9 | CCN(CC)CCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL333213 | 113927 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 633 | 12 | 0 | 9 | 5.9 | CCN(CC)CCN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44352652 | 116981 | 0 | None | -245 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 689 | 14 | 0 | 9 | 7.6 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC4CCCC4)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL339968 | 116981 | 0 | None | -245 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 689 | 14 | 0 | 9 | 7.6 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC4CCCC4)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
11282957 | 121819 | 0 | None | -1096 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
CHEMBL359894 | 121819 | 0 | None | -1096 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 477 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1 | 10.1021/jm049218c | ||
9983568 | 98525 | 0 | None | -263 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL279885 | 98525 | 0 | None | -263 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 503 | 10 | 1 | 6 | 4.6 | CCC(CC)N[C@@H](C)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
44576655 | 187638 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 570 | 9 | 2 | 8 | 3.6 | NCC(=O)OCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
CHEMBL499307 | 187638 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 570 | 9 | 2 | 8 | 3.6 | NCC(=O)OCc1ccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)cc1 | 10.1016/j.bmcl.2008.04.036 | ||
11238091 | 62177 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL178142 | 62177 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1016/j.bmcl.2004.02.004 | ||
CHEMBL311407 | 62177 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 | 10.1016/j.bmcl.2004.02.004 | ||
44451379 | 168414 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 884 | 17 | 4 | 10 | 6.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL439076 | 168414 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 884 | 17 | 4 | 10 | 6.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N[C@H](C(=O)NCC#Cc2ccccc2)C(C)C)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44352665 | 117771 | 0 | None | -43 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL340934 | 117771 | 0 | None | -43 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 635 | 13 | 0 | 9 | 6.3 | CCC(CC)OC(=O)c1cn(Cc2ccccc2F)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
10875519 | 188724 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 575 | 8 | 0 | 9 | 3.9 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCN(C)CC1 | 10.1021/jm0205402 | ||
CHEMBL51232 | 188724 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 575 | 8 | 0 | 9 | 3.9 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCN(C)CC1 | 10.1021/jm0205402 | ||
11294792 | 62958 | 0 | None | -380 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
CHEMBL179269 | 62958 | 0 | None | -380 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 491 | 8 | 1 | 6 | 4.3 | CN[C@@H](Cn1c(=O)c(-c2cccc(OC)c2)c(C)n(Cc2c(F)cccc2F)c1=O)c1ccccc1 | 10.1021/jm049218c | ||
11455176 | 98602 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL280430 | 98602 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11455176 | 98602 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL280430 | 98602 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44341074 | 9850 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 469 | 9 | 1 | 6 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL114619 | 9850 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 469 | 9 | 1 | 6 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCC3CC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
21045807 | 16138 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 590 | 8 | 2 | 5 | 7.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(C(F)(F)F)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL122653 | 16138 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 590 | 8 | 2 | 5 | 7.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(C(F)(F)F)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
11226171 | 87022 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL23337 | 87022 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11226171 | 87022 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
CHEMBL23337 | 87022 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 10 | 1 | 7 | 3.9 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCCc3ccccn3)c2=O)c1 | 10.1021/jm030472z | ||
44309617 | 202259 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 605 | 10 | 0 | 7 | 6.5 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(F)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL69361 | 202259 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 605 | 10 | 0 | 7 | 6.5 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4cccc(F)c4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
21047937 | 110809 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 472 | 7 | 1 | 3 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN(C)C)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL326606 | 110809 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 472 | 7 | 1 | 3 | 6.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3ccc(CN(C)C)cc3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44288079 | 99750 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 896 | 11 | 3 | 14 | 5.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](NC)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
CHEMBL288396 | 99750 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 896 | 11 | 3 | 14 | 5.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](NC)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1016/j.bmcl.2003.12.059 | ||
44267870 | 97669 | 0 | None | -8 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OCC2(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273536 | 97669 | 0 | None | -8 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OCC2(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11421518 | 164744 | 0 | None | -1047 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
CHEMBL423291 | 164744 | 0 | None | -1047 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 553 | 10 | 1 | 7 | 4.8 | COc1ccccc1CNC[C@@H](C)n1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm030472z | ||
44267904 | 97964 | 0 | None | -6 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL275521 | 97964 | 0 | None | -6 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 893 | 10 | 1 | 13 | 6.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2CCOC2C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
11103767 | 101324 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 5.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)CO)c(CN(C)Cc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
CHEMBL300079 | 101324 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 5.0 | COc1cccc(-c2c(C)n(Cc3ccccc3F)c3nc(C(C)(C)CO)c(CN(C)Cc4ccccn4)n3c2=O)c1 | 10.1021/jm0205402 | ||
44400188 | 69037 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 501 | 6 | 1 | 5 | 4.7 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL193031 | 69037 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 501 | 6 | 1 | 5 | 4.7 | N[C@@H](Cn1c(=O)c(-c2ccccc2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
44347047 | 16422 | 0 | None | -5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL124056 | 16422 | 0 | None | -5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(NC[C@@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm701249f | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm701249f | ||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049218c | ||
9984259 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
CHEMBL324912 | 110012 | 0 | None | 281 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.3 | CN[C@@H](Cc1ccccc1)Cn1c(=O)c(-c2cccc(OC)c2F)c(C)n(Cc2c(F)cccc2F)c1=O | 10.1021/jm049791w | ||
44400353 | 68332 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 599 | 8 | 1 | 6 | 5.7 | N[C@@H](Cn1c(=O)c(-c2cccc(OCC(F)(F)F)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL192096 | 68332 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 599 | 8 | 1 | 6 | 5.7 | N[C@@H](Cn1c(=O)c(-c2cccc(OCC(F)(F)F)c2F)cn(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2005.03.057 | ||
11307227 | 122537 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 539 | 8 | 1 | 6 | 5.8 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL360935 | 122537 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 539 | 8 | 1 | 6 | 5.8 | Cc1c(-c2ccc(Oc3ccccc3)cc2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL2371513 | 208319 | 0 | None | - | 1 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H]1CCC(=O)NCCC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCCN=C(N)N)NC1=O | 10.1021/jm990115h | ||||
44267870 | 97669 | 0 | None | 8 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OCC2(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
CHEMBL273536 | 97669 | 0 | None | 8 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 921 | 10 | 1 | 14 | 7.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OCC2(C)C)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)cc3)C(=O)O[C@]12C | 10.1021/jm030418i | ||
44309319 | 202019 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 609 | 12 | 1 | 8 | 5.9 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL67638 | 202019 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 609 | 12 | 1 | 8 | 5.9 | CCCC(=O)Nc1ccc(-c2nc3n(Cc4ccccc4F)cc(C(=O)OCC)c(=O)n3c2CN(C)Cc2ccccc2)cc1 | 10.1016/s0960-894x(02)00370-0 | ||
44435992 | 96060 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 597 | 10 | 0 | 8 | 4.8 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3ccccc3F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL262581 | 96060 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 597 | 10 | 0 | 8 | 4.8 | Cc1c(CN2CCc3c(c(=O)n(CCN(C)CCc4ccccn4)c(=O)n3Cc3ccccc3F)C2)sc2ccccc12 | 10.1016/j.bmc.2007.05.029 | ||
21047583 | 15128 | 0 | None | -10 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 607 | 9 | 2 | 7 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(N5CCOCC5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL121367 | 15128 | 0 | None | -10 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 607 | 9 | 2 | 7 | 6.7 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4nccc(N5CCOCC5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44352679 | 115002 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL335196 | 115002 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 653 | 13 | 0 | 9 | 6.2 | CCOC(=O)c1cn(Cc2c(F)cccc2F)c2c(C#N)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44387920 | 63553 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3F)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL180421 | 63553 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3ccccc3F)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL2370261 | 208077 | 0 | None | - | 1 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
CHEMBL329946 | 209577 | 0 | None | - | 1 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm990432o | ||||
44435981 | 146416 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 623 | 11 | 0 | 9 | 2.9 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(S(C)(=O)=O)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL392603 | 146416 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 623 | 11 | 0 | 9 | 2.9 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccc(S(C)(=O)=O)cc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44340641 | 110088 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 529 | 13 | 1 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCCCOCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL325391 | 110088 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 529 | 13 | 1 | 7 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NCCCOCC(C)C)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11260704 | 98222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 508 | 9 | 0 | 6 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
CHEMBL277439 | 98222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 508 | 9 | 0 | 6 | 4.0 | Cc1c(-c2ccccc2F)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm030472z | ||
44451446 | 168151 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1663 | 36 | 8 | 20 | 10.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2cccc(C#CCNC(=O)CCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL436862 | 168151 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1663 | 36 | 8 | 20 | 10.1 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2cccc(C#CCNC(=O)CCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
11249548 | 98633 | 0 | None | 97 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL280664 | 98633 | 0 | None | 97 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 530 | 9 | 1 | 8 | 4.1 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](C)NCc3nccs3)c2=O)c1F | 10.1021/jm030472z | ||
44387922 | 60222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3ccc(F)cc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175869 | 60222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 512 | 8 | 1 | 8 | 2.7 | COc1cccc(-n2c(=O)n(CCC(N)c3ccc(F)cc3)c(=O)n(Cc3c(F)cccc3F)c2=O)c1 | 10.1016/j.bmcl.2005.05.038 | ||
9823968 | 109992 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 429 | 5 | 1 | 2 | 6.8 | Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL324771 | 109992 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 429 | 5 | 1 | 2 | 6.8 | Cc1ccc(CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)cc1 | 10.1016/s0960-894x(02)00755-2 | ||
21046570 | 112588 | 0 | None | -34 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 6 | 1 | 4 | 6.2 | COC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL331277 | 112588 | 0 | None | -34 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 479 | 6 | 1 | 4 | 6.2 | COC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)CC1 | 10.1016/s0960-894x(02)00755-2 | ||
44340643 | 110856 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCN(CCc4ccccn4)C3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL326885 | 110856 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 532 | 8 | 0 | 7 | 4.2 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C3CCN(CCc4ccccn4)C3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44451343 | 96019 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1591 | 34 | 8 | 18 | 9.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CCCNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL262335 | 96019 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1591 | 34 | 8 | 18 | 9.9 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCCCC(=O)NCC#Cc2ccccc2C#CCNC(=O)CCCNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44340824 | 9381 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3cccc(F)c3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL111933 | 9381 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3cccc(F)c3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44435984 | 88352 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 10 | 0 | 7 | 3.8 | Cc1ccccc1CN1CCc2c(c(=O)n(CCN(C)CCc3ccccn3)c(=O)n2Cc2c(F)cccc2F)C1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236332 | 88352 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 559 | 10 | 0 | 7 | 3.8 | Cc1ccccc1CN1CCc2c(c(=O)n(CCN(C)CCc3ccccn3)c(=O)n2Cc2c(F)cccc2F)C1 | 10.1016/j.bmc.2007.05.029 | ||
44435983 | 88351 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 579 | 10 | 0 | 7 | 4.1 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1cccc(Cl)c1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236331 | 88351 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 579 | 10 | 0 | 7 | 4.1 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1cccc(Cl)c1)C2 | 10.1016/j.bmc.2007.05.029 | ||
44451258 | 166872 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1729 | 32 | 8 | 20 | 8.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL429690 | 166872 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1729 | 32 | 8 | 20 | 8.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)ccc(=O)n3c2CN(CC(=O)NCC(=O)N2CCC[C@H]2C(=O)NCC#Cc2ccccc2C#CCNC(=O)[C@@H]2CCCN2C(=O)CNC(=O)CN(Cc2ccccc2)Cc2c(-c3ccc(NC(=O)NCC)cc3)nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n23)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44352942 | 22411 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 609 | 11 | 0 | 9 | 5.6 | CCOC(=O)c1cn(Cc2ccccc2Cl)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL132661 | 22411 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 609 | 11 | 0 | 9 | 5.6 | CCOC(=O)c1cn(Cc2ccccc2Cl)c2c(C#N)c(-c3ccc(OC)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(01)00779-x | ||
44388018 | 60152 | 0 | None | 389 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL175443 | 60152 | 0 | None | 389 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 487 | 7 | 1 | 9 | 1.9 | COc1cccc(-n2c(=O)n(Cc3ccccc3C#N)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
21047784 | 110148 | 0 | None | -36 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 574 | 9 | 4 | 7 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4cc(O)nc(O)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL325747 | 110148 | 0 | None | -36 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 574 | 9 | 4 | 7 | 6.1 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCC(CNCc4cc(O)nc(O)n4)CC3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
11191675 | 63052 | 0 | None | 186 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL179600 | 63052 | 0 | None | 186 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL3085404 | 63052 | 0 | None | 186 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NC3CCC3)c2=O)c1F | 10.1021/jm030472z | ||
11226531 | 99059 | 0 | None | 169 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
CHEMBL283381 | 99059 | 0 | None | 169 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 543 | 9 | 1 | 7 | 5.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)NCc3sccc3C)c2=O)c1F | 10.1021/jm030472z | ||
44389647 | 64243 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 455 | 6 | 1 | 7 | 3.4 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2)CO3)c1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL181582 | 64243 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 455 | 6 | 1 | 7 | 3.4 | COc1cccc(-c2c3n(c(=O)n(CC(N)c4ccccc4)c2=O)C(c2ccccc2)CO3)c1 | 10.1016/j.bmcl.2005.01.009 | ||
44346665 | 112339 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 636 | 10 | 1 | 7 | 7.7 | CC(C)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL330834 | 112339 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 636 | 10 | 1 | 7 | 7.7 | CC(C)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1 | 10.1016/s0960-894x(03)00746-7 | ||
11284357 | 60692 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1021/jm049218c | ||
CHEMBL176270 | 60692 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1021/jm049218c | ||
CHEMBL72913 | 60692 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.1 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 | 10.1021/jm049218c | ||
11329628 | 62695 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1021/jm049218c | ||
CHEMBL178805 | 62695 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1021/jm049218c | ||
CHEMBL73575 | 62695 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 393 | 6 | 1 | 5 | 3.2 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 | 10.1021/jm049218c | ||
CHEMBL405837 | 210837 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H]1CSSC[C@@H]2NC(=O)[C@@H](CC(=O)NC[C@H](C(N)=O)NC(=O)[C@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC2=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC1=O | 10.1021/jm990116+ | ||||
44390758 | 64615 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 7 | 2.3 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
CHEMBL182284 | 64615 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 468 | 6 | 1 | 7 | 2.3 | N[C@@H](Cn1c(=O)n(Cc2c(F)cccc2F)c(=O)n(-c2ccccc2F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2004.11.026 | ||
44340652 | 9364 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL111820 | 9364 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 534 | 10 | 0 | 7 | 4.3 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](C)N(C)CCc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
21047631 | 10858 | 0 | None | -5 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CN)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL117330 | 10858 | 0 | None | -5 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 450 | 6 | 2 | 3 | 6.0 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(CN)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44352657 | 21351 | 0 | None | -269 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 687 | 12 | 0 | 9 | 7.3 | CN(CCc1ccccn1)Cc1c(-c2ccc(OC3CCCC3)cc2)c(C#N)c2n(Cc3ccccc3F)cc(C(=O)OC3CCCC3)c(=O)n12 | 10.1016/s0960-894x(01)00779-x | ||
CHEMBL131665 | 21351 | 0 | None | -269 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 687 | 12 | 0 | 9 | 7.3 | CN(CCc1ccccn1)Cc1c(-c2ccc(OC3CCCC3)cc2)c(C#N)c2n(Cc3ccccc3F)cc(C(=O)OC3CCCC3)c(=O)n12 | 10.1016/s0960-894x(01)00779-x | ||
44387896 | 129152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
CHEMBL367388 | 129152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1021/jm701249f | ||
44394778 | 125366 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 544 | 8 | 1 | 7 | 5.1 | Cc1c(-c2csc(Cc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
CHEMBL364842 | 125366 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 544 | 8 | 1 | 7 | 5.1 | Cc1c(-c2csc(Cc3ccccc3)n2)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1016/j.bmcl.2004.07.022 | ||
9852184 | 10589 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 628 | 13 | 0 | 8 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL117069 | 10589 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 628 | 13 | 0 | 8 | 6.4 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)CCc3ccccn3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
44346396 | 112873 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 625 | 9 | 0 | 9 | 6.1 | CN(Cc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
CHEMBL331762 | 112873 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 625 | 9 | 0 | 9 | 6.1 | CN(Cc1ccccn1)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F | 10.1016/s0960-894x(03)00746-7 | ||
44387896 | 129152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL367388 | 129152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 7 | 1 | 8 | 2.3 | COc1cccc(-n2c(=O)n(Cc3c(F)cccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44347005 | 113966 | 0 | None | 6 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 613 | 10 | 3 | 7 | 7.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(Nc4nccc(NCC5CCCO5)n4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333461 | 113966 | 0 | None | 6 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 613 | 10 | 3 | 7 | 7.3 | Cc1cc2c(cc1Cc1ccc(C(=O)NCC3CCCC(Nc4nccc(NCC5CCCO5)n4)C3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
44400247 | 121528 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 571 | 10 | 2 | 9 | 2.5 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)CCO)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
CHEMBL359558 | 121528 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 571 | 10 | 2 | 9 | 2.5 | COc1cccc(-c2cn(Cc3c(F)cccc3S(=O)(=O)CCO)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.03.057 | ||
44353288 | 167794 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 662 | 13 | 2 | 7 | 6.4 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC4CCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
CHEMBL434423 | 167794 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 662 | 13 | 2 | 7 | 6.4 | CCCC(=O)Nc1ccc(-c2cc3n(Cc4ccccc4F)cc(C(=O)NC4CCCC4)c(=O)n3c2CN(C)CCc2ccccn2)cc1 | 10.1016/s0960-894x(01)00780-6 | ||
44587403 | 188240 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 647 | 13 | 2 | 8 | 4.8 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCOCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL506338 | 188240 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 647 | 13 | 2 | 8 | 4.8 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCOCC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
10394119 | 113949 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL333345 | 113949 | 0 | None | -1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 621 | 11 | 3 | 7 | 7.5 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CNc4ccnc(NC[C@H]5CCCO5)n4)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00756-4 | ||
CHEMBL438712 | 212039 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H]1CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm990116+ | ||||
44340623 | 9389 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL111980 | 9389 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@H](C)CNCc3ccccc3F)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
21047633 | 163922 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CN)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL421418 | 163922 | 0 | None | 1 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CN)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
44343881 | 10877 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 603 | 12 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)Cc3ccco3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
CHEMBL117346 | 10877 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 603 | 12 | 0 | 8 | 6.5 | CCOC(=O)c1cn(Cc2ccccc2F)c2c(F)c(-c3ccc(OCC(C)C)cc3)c(CN(C)Cc3ccco3)n2c1=O | 10.1016/s0960-894x(02)00745-x | ||
11082604 | 101289 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 608 | 8 | 0 | 8 | 5.7 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCc2ccccc2C1 | 10.1021/jm0205402 | ||
CHEMBL299850 | 101289 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 608 | 8 | 0 | 8 | 5.7 | COC(=O)C(C)(C)c1nc2n(Cc3ccccc3F)c(C)c(-c3cccc(OC)c3)c(=O)n2c1CN1CCc2ccccc2C1 | 10.1021/jm0205402 | ||
22716607 | 64448 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 493 | 5 | 1 | 6 | 4.9 | NC(Cn1c(=O)c(-c2ccccc2Cl)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
CHEMBL181945 | 64448 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 493 | 5 | 1 | 6 | 4.9 | NC(Cn1c(=O)c(-c2ccccc2Cl)c2n(c1=O)C(c1ccccc1F)CS2)c1ccccc1 | 10.1016/j.bmcl.2005.01.009 | ||
44451419 | 96500 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1687 | 30 | 6 | 20 | 10.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@@H]3CCCN3C(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL266172 | 96500 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1687 | 30 | 6 | 20 | 10.3 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)N2CCC[C@H]2C(=O)NCC#Cc2cccc(C#CCNC(=O)[C@@H]3CCCN3C(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
44451430 | 155373 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1719 | 40 | 8 | 20 | 11.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2cccc(C#CCNC(=O)CCCCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
CHEMBL406084 | 155373 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 1719 | 40 | 8 | 20 | 11.6 | CCNC(=O)Nc1ccc(-c2nc3n(Cc4c(F)cccc4F)cc(C(=O)OCC)c(=O)n3c2CN(CC(=O)NCCCCCC(=O)NCC#Cc2cccc(C#CCNC(=O)CCCCCNC(=O)CN(Cc3ccccc3)Cc3c(-c4ccc(NC(=O)NCC)cc4)nc4n(Cc5c(F)cccc5F)cc(C(=O)OCC)c(=O)n34)c2)Cc2ccccc2)cc1 | 10.1016/j.bmc.2008.01.054 | ||
21047633 | 163922 | 0 | None | -1 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CN)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
CHEMBL421418 | 163922 | 0 | None | -1 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 444 | 6 | 2 | 3 | 5.9 | Cc1cc2c(cc1Cc1ccc(C(=O)NCc3cccc(CN)c3)o1)C(C)(C)CCC2(C)C | 10.1016/s0960-894x(02)00755-2 | ||
11431754 | 13187 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 487 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119185 | 13187 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 487 | 7 | 1 | 6 | 4.0 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C3CCCC3)c2=O)c1F | 10.1021/jm049791w | ||
44387961 | 165468 | 0 | None | -144 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
CHEMBL425523 | 165468 | 0 | None | -144 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 546 | 8 | 1 | 9 | 3.0 | COc1cccc(-n2c(=O)n(Cc3ccccc3OC(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1F | 10.1016/j.bmcl.2005.05.038 | ||
44436001 | 161133 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 598 | 8 | 0 | 6 | 5.6 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4Cc4ccccc4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL413239 | 161133 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 598 | 8 | 0 | 6 | 5.6 | Cc1ccc(CN2CCc3c(c(=O)n(CC4CCCCN4Cc4ccccc4)c(=O)n3Cc3c(F)cccc3F)C2)c(C)c1 | 10.1016/j.bmc.2007.05.029 | ||
44309671 | 202159 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 554 | 10 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
CHEMBL68664 | 202159 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 554 | 10 | 0 | 8 | 5.2 | CCOC(=O)c1cn(Cc2ccccc2F)c2nc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)n2c1=O | 10.1016/s0960-894x(02)00370-0 | ||
44340642 | 9578 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 483 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNC3CCCC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
CHEMBL112881 | 9578 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 483 | 8 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n([C@@H](C)CNC3CCCC3)c2=O)c1 | 10.1016/s0960-894x(03)00619-x | ||
44309388 | 102073 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 609 | 7 | 0 | 9 | 5.2 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN2CCCN(C)CC2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
CHEMBL304067 | 102073 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 609 | 7 | 0 | 9 | 5.2 | COc1ccc(-c2nc3n(Cc4ccccc4F)c(C)c(-c4ccc5c(c4)OCO5)c(=O)n3c2CN2CCCN(C)CC2)cc1 | 10.1016/s0960-894x(02)00371-2 | ||
44340688 | 9518 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 9 | 0 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
CHEMBL112611 | 9518 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 9 | 0 | 7 | 3.8 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CCN(C)Cc3ccccn3)c2=O)c1 | 10.1016/s0960-894x(03)00620-6 | ||
11489334 | 10393 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CCc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL116576 | 10393 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 523 | 9 | 1 | 6 | 4.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)CCc3ccccc3)c2=O)c1F | 10.1021/jm049791w | ||
11294949 | 13927 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C(C)C)c2=O)c1F | 10.1021/jm049218c | ||
CHEMBL119739 | 13927 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C(C)C)c2=O)c1F | 10.1021/jm049218c | ||
44435818 | 88676 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 399 | 4 | 1 | 6 | 2.0 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CNCC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL236545 | 88676 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 399 | 4 | 1 | 6 | 2.0 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CNCC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
11294949 | 13927 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C(C)C)c2=O)c1F | 10.1021/jm049791w | ||
CHEMBL119739 | 13927 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 461 | 7 | 1 | 6 | 3.4 | COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(C[C@@H](N)C(C)C)c2=O)c1F | 10.1021/jm049791w | ||
44587400 | 172602 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 660 | 13 | 2 | 8 | 4.7 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCN(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
CHEMBL452198 | 172602 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 660 | 13 | 2 | 8 | 4.7 | CN[C@@H](Cn1c(=O)c(-c2cccc(OCCN(C)CC(=O)O)c2F)c(C)n(Cc2c(F)cccc2C(F)(F)F)c1=O)c1ccccc1 | 10.1016/j.bmcl.2008.07.059 | ||
11157017 | 121874 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1021/jm049218c | ||
CHEMBL360056 | 121874 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1021/jm049218c | ||
CHEMBL72199 | 121874 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 430 | 6 | 1 | 6 | 3.3 | Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 | 10.1021/jm049218c | ||
44435822 | 153657 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 519 | 7 | 0 | 7 | 3.9 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccccc2OC)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL398583 | 153657 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 519 | 7 | 0 | 7 | 3.9 | COc1cccc(-n2c(=O)c3c(n(Cc4c(F)cccc4F)c2=O)CN(Cc2ccccc2OC)CC3)c1 | 10.1016/j.bmc.2007.05.029 | ||
44435825 | 88076 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 545 | 10 | 0 | 7 | 3.5 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccccc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
CHEMBL235084 | 88076 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 545 | 10 | 0 | 7 | 3.5 | CN(CCc1ccccn1)CCn1c(=O)c2c(n(Cc3c(F)cccc3F)c1=O)CCN(Cc1ccccc1)C2 | 10.1016/j.bmc.2007.05.029 | ||
11455317 | 62559 | 0 | None | -851 | 2 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
CHEMBL178457 | 62559 | 0 | None | -851 | 2 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 491 | 6 | 1 | 7 | 3.7 | Cc1c(-c2ccc3c(c2)OCO3)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F | 10.1021/jm049218c | ||
11980076 | 206711 | 27 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | None | ||||
CHEMBL1007 | 206711 | 27 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | None | None | None | CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O | None | ||||
1175 | 2266 | 38 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
1559 | 2266 | 38 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
657181 | 2266 | 38 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
DB00007 | 2266 | 38 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
3823 | 49951 | 38 | None | -1 | 11 | Rat | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | None | ||
76973198 | 49951 | 38 | None | -1 | 11 | Rat | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | None | ||
CHEMBL157101 | 49951 | 38 | None | -1 | 11 | Rat | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 530 | 7 | 0 | 7 | 4.2 | CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 | None | ||
25077405 | 2675 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
3902 | 2675 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1201309 | 2675 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
DB00666 | 2675 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
1162 | 1801 | 0 | None | 16 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
16132914 | 1801 | 0 | None | 16 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
3878 | 1803 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | Guide to Pharmacology | None | None | None | None | 17254668 | ||||
188304 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9341 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL3272563 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9342 | 323 | 0 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9855027 | 323 | 0 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL3272561 | 323 | 0 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9344 | 1903 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
25077495 | 1363 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9343 | 1363 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL2365665 | 1363 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
DB11510 | 1363 | 0 | None | - | 1 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
3860 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
3860 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
436 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
436 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
50225 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
50225 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
CHEMBL2110824 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL2110824 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
DB06719 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
DB06719 | 733 | 0 | None | 57 | 2 | Human | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 26774084 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.7 | pKd | None | 9.7 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 16930559 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.7 | pKd | None | 9.7 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 16930559 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.7 | pKd | None | 9.7 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 16930559 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.7 | pKd | None | 9.7 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 16930559 | ||
11250647 | 1516 | 40 | None | -117 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
5293 | 1516 | 40 | None | -117 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
8362 | 1516 | 40 | None | -117 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
CHEMBL1208155 | 1516 | 40 | None | -117 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
DB11979 | 1516 | 40 | None | -117 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | None | ||
101755083 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
1190 | 869 | 41 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
583 | 869 | 41 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
1177 | 3806 | 0 | None | -10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
25074470 | 3806 | 0 | None | -10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
2968 | 3806 | 0 | None | -10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1201334 | 3806 | 0 | None | -10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
DB06825 | 3806 | 0 | None | -10 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
1188 | 217 | 40 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
16131215 | 217 | 40 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
35 | 217 | 40 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1252 | 217 | 40 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
DB00106 | 217 | 40 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
11225 | 1096 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 645 | 10 | 0 | 6 | 6.0 | FCCOc1cccc(c1F)c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(c1=O)C[C@H](N1CCCC1=O)c1ccccc1 | 32677155 | ||
154699464 | 1096 | 0 | None | - | 1 | Rat | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 645 | 10 | 0 | 6 | 6.0 | FCCOc1cccc(c1F)c1c(C)n(Cc2c(F)cccc2C(F)(F)F)c(=O)n(c1=O)C[C@H](N1CCCC1=O)c1ccccc1 | 32677155 | ||
1162 | 1801 | 0 | None | -16 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
16132914 | 1801 | 0 | None | -16 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
1162 | 1801 | 0 | None | 16 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
1162 | 1801 | 0 | None | 16 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
16132914 | 1801 | 0 | None | 16 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
16132914 | 1801 | 0 | None | 16 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
1162 | 1801 | 0 | None | 16 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
16132914 | 1801 | 0 | None | 16 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
101755083 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
16136245 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
4379 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
5585 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
CHEMBL415606 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
DB06699 | 1332 | 42 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 21188095 | ||||
1175 | 2266 | 38 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
1559 | 2266 | 38 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
657181 | 2266 | 38 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
CHEMBL1201199 | 2266 | 38 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
DB00007 | 2266 | 38 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
11250647 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 19006286 | ||
11250647 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 30194661 | ||
5293 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 19006286 | ||
5293 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 30194661 | ||
8362 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 19006286 | ||
8362 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 30194661 | ||
CHEMBL1208155 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 19006286 | ||
CHEMBL1208155 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 30194661 | ||
DB11979 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 19006286 | ||
DB11979 | 1516 | 40 | None | 117 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 30194661 | ||
188304 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9341 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL3272563 | 1601 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9342 | 323 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9855027 | 323 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL3272561 | 323 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9344 | 1903 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
1188 | 217 | 40 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
16131215 | 217 | 40 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
35 | 217 | 40 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
CHEMBL1252 | 217 | 40 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
DB00106 | 217 | 40 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
1177 | 3806 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
25074470 | 3806 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
2968 | 3806 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
CHEMBL1201334 | 3806 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
DB06825 | 3806 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
101827019 | 2075 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850267 | ||||
16130938 | 2075 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850267 | ||||
3854 | 2075 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850267 | ||||
73952264 | 2075 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850267 | ||||
CHEMBL3989438 | 2075 | 0 | None | - | 1 | Human | 9.5 | pKi | = | 9.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850267 | ||||
25077495 | 1363 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
9343 | 1363 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL2365665 | 1363 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
DB11510 | 1363 | 0 | None | - | 1 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
1190 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
1190 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7649152 | ||||
1190 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7649152 | ||||
25074887 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
583 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
583 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7649152 | ||||
583 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7649152 | ||||
CHEMBL1200490 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7649152 | ||||
DB00050 | 869 | 41 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
3860 | 733 | 0 | None | 57 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
436 | 733 | 0 | None | 57 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
50225 | 733 | 0 | None | 57 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
CHEMBL2110824 | 733 | 0 | None | 57 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
DB06719 | 733 | 0 | None | 57 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 26398856 | ||||
1180 | 1276 | 0 | None | - | 1 | Human | 10.0 | pKi | None | 10 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
1185 | 3645 | 32 | None | - | 1 | Human | 10.0 | pKi | None | 10 | Binding | Guide to Pharmacology | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 12502365 | ||
3038517 | 3645 | 32 | None | - | 1 | Human | 10.0 | pKi | None | 10 | Binding | Guide to Pharmacology | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 12502365 | ||
CHEMBL22055 | 3645 | 32 | None | - | 1 | Human | 10.0 | pKi | None | 10 | Binding | Guide to Pharmacology | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 12502365 | ||
DB06494 | 3645 | 32 | None | - | 1 | Human | 10.0 | pKi | None | 10 | Binding | Guide to Pharmacology | 667 | 10 | 2 | 8 | 6.5 | CONC(=O)Nc1ccc(cc1)c1sc2c(c1CN(Cc1ccccc1)C)c(=O)n(c(=O)n2Cc1c(F)cccc1F)c1ccccc1 | 12502365 | ||
1191 | 1262 | 0 | None | - | 1 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
1170 | 1900 | 0 | None | - | 1 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 17095587 | ||||
1179 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 12606616 | ||
9957278 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 12606616 | ||
CHEMBL494803 | 947 | 31 | None | -4 | 3 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 491 | 7 | 1 | 5 | 6.8 | COc1cc(OC)c(c(c1)OC)NC(=O)c1ccc(o1)Cc1cc2c(cc1C)C(C)(C)CCC2(C)C | 12606616 | ||
10279142 | 1596 | 0 | None | - | 1 | Human | 8.3 | pKi | None | 8.3 | Binding | Guide to Pharmacology | 509 | 7 | 1 | 8 | 6.0 | COc1nc(OC)c(c(n1)OC)NC(=O)c1ccc(o1)Oc1cc2c(cc1C)C(C)(C)C(CC2(C)C)C | 18344315 | ||
1182 | 1596 | 0 | None | - | 1 | Human | 8.3 | pKi | None | 8.3 | Binding | Guide to Pharmacology | 509 | 7 | 1 | 8 | 6.0 | COc1nc(OC)c(c(n1)OC)NC(=O)c1ccc(o1)Oc1cc2c(cc1C)C(C)(C)C(CC2(C)C)C | 18344315 | ||
1181 | 1277 | 0 | None | - | 1 | Human | 8.6 | pKi | None | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
1177 | 3806 | 0 | None | -10 | 2 | Rat | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
25074470 | 3806 | 0 | None | -10 | 2 | Rat | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
2968 | 3806 | 0 | None | -10 | 2 | Rat | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
CHEMBL1201334 | 3806 | 0 | None | -10 | 2 | Rat | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
DB06825 | 3806 | 0 | None | -10 | 2 | Rat | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 11726197 | ||||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
11167850 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
1178 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
1187 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
CHEMBL179691 | 2701 | 22 | None | 6309 | 2 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 495 | 7 | 1 | 6 | 4.2 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)N)c(=O)n(c1C)Cc1c(F)cccc1F | 17095587 | ||
1189 | 423 | 0 | None | - | 1 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 | ||||
16132443 | 423 | 0 | None | - | 1 | Human | 9.6 | pKi | None | 9.6 | Binding | Guide to Pharmacology | None | None | None | None | 9300077 |