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 |
| CHEMBL3980643 | 210767 | 0 | None | 6 | 2 | Human | 10.0 | pIC50 | = | 10 | Functional | 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](Cc1cnc[nH]1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H]2CSSC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)[C@@H](C)CC | 10.1016/j.ejmech.2016.06.006 | ||||
| 5311032 | 59930 | 26 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.ejmech.2016.06.006 | ||
| CHEMBL1515091 | 59930 | 26 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.ejmech.2016.06.006 | ||
| CHEMBL1741040 | 59930 | 26 | None | - | 1 | Human | 9.4 | pIC50 | = | 9.4 | Functional | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.ejmech.2016.06.006 | ||
| 10187997 | 109484 | 0 | None | -4 | 4 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL323464 | 109484 | 0 | None | -4 | 4 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL284250 | 209115 | 0 | None | 1 | 4 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1016/0960-894X(95)00237-N | ||||
| 10603409 | 110115 | 0 | None | -1 | 4 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL325581 | 110115 | 0 | None | -1 | 4 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| 10210629 | 8676 | 0 | None | -7 | 4 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL109644 | 8676 | 0 | None | -7 | 4 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL3143473 | 209588 | 0 | None | 1071 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CCCC[C@@H](NC(=O)[C@@H](Cc1cn(COC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| CHEMBL3305972 | 209588 | 0 | None | 1071 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CCCC[C@@H](NC(=O)[C@@H](Cc1cn(COC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| 9916235 | 9263 | 1 | None | -4 | 4 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL111277 | 9263 | 1 | None | -4 | 4 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10651488 | 162827 | 0 | None | -1 | 4 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| CHEMBL419367 | 162827 | 0 | None | -1 | 4 | Human | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| 11318978 | 167340 | 0 | None | -7 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 560 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL431286 | 167340 | 0 | None | -7 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 560 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11387205 | 111073 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 544 | 8 | 2 | 7 | 4.5 | COc1ccc(CN2C(=O)CN[C@](C3CCCCC3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL328073 | 111073 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 544 | 8 | 2 | 7 | 4.5 | COc1ccc(CN2C(=O)CN[C@](C3CCCCC3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 10298354 | 111514 | 0 | None | -15 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 462 | 7 | 3 | 7 | 1.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCO)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL328878 | 111514 | 0 | None | -15 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 462 | 7 | 3 | 7 | 1.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCO)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10187313 | 106958 | 0 | None | -18 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL318247 | 106958 | 0 | None | -18 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11169125 | 205825 | 0 | None | -5 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 574 | 7 | 2 | 4 | 6.5 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL94802 | 205825 | 0 | None | -5 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 574 | 7 | 2 | 4 | 6.5 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 10303258 | 161327 | 0 | None | -3 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 564 | 10 | 2 | 6 | 5.3 | CCCCc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL415010 | 161327 | 0 | None | -3 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 564 | 10 | 2 | 6 | 5.3 | CCCCc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 9957883 | 98204 | 0 | None | -25 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL27732 | 98204 | 0 | None | -25 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 9890440 | 8170 | 0 | None | -301 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 460 | 6 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(C)c2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL10924 | 8170 | 0 | None | -301 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 460 | 6 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(C)c2)cc1 | 10.1021/jm00008a002 | ||
| 11753582 | 205854 | 0 | None | -4 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 586 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(Br)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94962 | 205854 | 0 | None | -4 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 586 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(Br)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 3951 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1021/jm031115r | ||
| 4337 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1021/jm031115r | ||
| 6918493 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1021/jm031115r | ||
| CHEMBL1111 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1021/jm031115r | ||
| DB06403 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1021/jm031115r | ||
| 11753090 | 105722 | 0 | None | -7 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(Cl)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL313870 | 105722 | 0 | None | -7 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(Cl)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11398658 | 205865 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)cc(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL95017 | 205865 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)cc(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10120430 | 205787 | 0 | None | -5 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)ccc(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94580 | 205787 | 0 | None | -5 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)ccc(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11330923 | 206087 | 0 | None | 1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 606 | 10 | 2 | 6 | 6.3 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(C)cc(C)cc3C)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96303 | 206087 | 0 | None | 1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 606 | 10 | 2 | 6 | 6.3 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(C)cc(C)cc3C)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96822 | 214143 | 0 | None | 1 | 2 | Rat | 5.9 | pIC50 | = | 5.9 | Functional | 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](NS(C)(=O)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 11238540 | 205792 | 0 | None | -11 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 576 | 8 | 2 | 5 | 5.9 | COc1cccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL94602 | 205792 | 0 | None | -11 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 576 | 8 | 2 | 5 | 5.9 | COc1cccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 10166139 | 162792 | 0 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 550 | 7 | 2 | 6 | 4.9 | Cc1cc(C)c(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)c(C)c1 | 10.1021/jm031115r | ||
| CHEMBL419136 | 162792 | 0 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 550 | 7 | 2 | 6 | 4.9 | Cc1cc(C)c(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)c(C)c1 | 10.1021/jm031115r | ||
| 11376627 | 107146 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(C(F)(F)F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL319007 | 107146 | 0 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(C(F)(F)F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11386977 | 205813 | 0 | None | -1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 528 | 8 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCC3CCCCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94752 | 205813 | 0 | None | -1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 528 | 8 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCC3CCCCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 9955200 | 9242 | 0 | None | -380 | 3 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL11115 | 9242 | 0 | None | -380 | 3 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm00008a002 | ||
| 11318409 | 205722 | 0 | None | -3 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1cccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL94212 | 205722 | 0 | None | -3 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1cccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL413825 | 211339 | 0 | None | 4 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(95)00084-7 | ||||
| 10230737 | 111828 | 0 | None | -16 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL329251 | 111828 | 0 | None | -16 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 18995992 | 99377 | 0 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28563 | 99377 | 0 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 18995991 | 99836 | 0 | None | -9 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1cc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc(OC)c1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28920 | 99836 | 0 | None | -9 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1cc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc(OC)c1OC | 10.1016/0960-894X(96)00232-6 | ||
| 10342643 | 5088 | 0 | None | -144 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm00008a002 | ||
| CHEMBL10588 | 5088 | 0 | None | -144 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm00008a002 | ||
| 11752174 | 172156 | 0 | None | -4 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 489 | 8 | 2 | 7 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCN(C)C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL450628 | 172156 | 0 | None | -4 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 489 | 8 | 2 | 7 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCN(C)C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11410074 | 206055 | 0 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 536 | 9 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCCc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96114 | 206055 | 0 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 536 | 9 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCCc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11421392 | 205653 | 0 | None | -5 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL93820 | 205653 | 0 | None | -5 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11387315 | 205701 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 552 | 8 | 2 | 7 | 4.3 | COc1ccc(CN2C(=O)CN[C@](c3ccc(C)cc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL94091 | 205701 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 552 | 8 | 2 | 7 | 4.3 | COc1ccc(CN2C(=O)CN[C@](c3ccc(C)cc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11397857 | 206056 | 0 | None | -6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 496 | 7 | 2 | 6 | 3.7 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccc(Cl)cc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96125 | 206056 | 0 | None | -6 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 496 | 7 | 2 | 6 | 3.7 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccc(Cl)cc32)c1 | 10.1021/jm031115r | ||
| 10224745 | 112193 | 0 | None | -15 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 5 | 2 | 6 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL330425 | 112193 | 0 | None | -15 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 432 | 5 | 2 | 6 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11226740 | 206165 | 0 | None | -9 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 558 | 7 | 2 | 4 | 6.0 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96704 | 206165 | 0 | None | -9 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 558 | 7 | 2 | 4 | 6.0 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL328942 | 209570 | 0 | None | -1 | 4 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| CHEMBL433406 | 211892 | 0 | None | 9 | 2 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | 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](NC(=O)NC)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10187261 | 111052 | 0 | None | -3 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(Cl)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL327976 | 111052 | 0 | None | -3 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(Cl)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11489318 | 206064 | 0 | None | -5 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 522 | 8 | 2 | 6 | 4.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96171 | 206064 | 0 | None | -5 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 522 | 8 | 2 | 6 | 4.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 15289330 | 99341 | 0 | None | -18 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL285368 | 99341 | 0 | None | -18 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 10230546 | 106763 | 0 | None | -4 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 538 | 8 | 2 | 7 | 4.0 | COc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL316878 | 106763 | 0 | None | -4 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 538 | 8 | 2 | 7 | 4.0 | COc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11273181 | 206130 | 0 | None | 4 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3C(F)(F)F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96506 | 206130 | 0 | None | 4 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3C(F)(F)F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 44327659 | 109334 | 0 | None | 1 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 937 | 26 | 9 | 8 | 4.6 | CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(c1ccccc1)c1ccccc1 | 10.1021/jm00015a003 | ||
| CHEMBL323331 | 109334 | 0 | None | 1 | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 937 | 26 | 9 | 8 | 4.6 | CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(c1ccccc1)c1ccccc1 | 10.1021/jm00015a003 | ||
| 9955200 | 9242 | 0 | None | -53 | 3 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL11115 | 9242 | 0 | None | -53 | 3 | Rat | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm00008a002 | ||
| 345351 | 9269 | 1 | None | -24 | 3 | Rat | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| CHEMBL11131 | 9269 | 1 | None | -24 | 3 | Rat | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| 11365059 | 206060 | 0 | None | -1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 564 | 7 | 2 | 6 | 5.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(C)(C)C)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96154 | 206060 | 0 | None | -1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 564 | 7 | 2 | 6 | 5.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(C)(C)C)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11467573 | 106756 | 0 | None | -9 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 606 | 8 | 2 | 7 | 5.0 | COc1ccc(CN2C(=O)CN[C@](c3cccc(C(F)(F)F)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL316851 | 106756 | 0 | None | -9 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 606 | 8 | 2 | 7 | 5.0 | COc1ccc(CN2C(=O)CN[C@](c3cccc(C(F)(F)F)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11331242 | 106936 | 0 | None | -1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 652 | 8 | 2 | 6 | 7.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3cccc(-c4ccccc4)c3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL318086 | 106936 | 0 | None | -1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 652 | 8 | 2 | 6 | 7.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3cccc(-c4ccccc4)c3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11342005 | 205815 | 0 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)c(F)c(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94766 | 205815 | 0 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)c(F)c(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11307805 | 106857 | 0 | None | -3 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 586 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(Br)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL317589 | 106857 | 0 | None | -3 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 586 | 7 | 2 | 6 | 4.8 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(Br)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10226239 | 206152 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 456 | 5 | 2 | 8 | 2.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3nnc(C)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96614 | 206152 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 456 | 5 | 2 | 8 | 2.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3nnc(C)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| 44328057 | 96446 | 0 | None | 7 | 2 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 986 | 26 | 9 | 9 | 4.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1cccnc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL265734 | 96446 | 0 | None | 7 | 2 | Rat | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 986 | 26 | 9 | 9 | 4.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1cccnc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11156376 | 112169 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 504 | 9 | 3 | 7 | 2.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCCC(=O)O)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL330359 | 112169 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 504 | 9 | 3 | 7 | 2.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCCC(=O)O)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11375934 | 206176 | 0 | None | -3 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96746 | 206176 | 0 | None | -3 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11156301 | 78254 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 500 | 7 | 3 | 9 | 2.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3nnc(CC(=O)O)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL2112377 | 78254 | 0 | None | -4 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 500 | 7 | 3 | 9 | 2.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3nnc(CC(=O)O)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10070783 | 96609 | 0 | None | -5 | 3 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| CHEMBL267094 | 96609 | 0 | None | -5 | 3 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| 11478911 | 155769 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 598 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)c(F)c(F)c(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL406551 | 155769 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 598 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)c(F)c(F)c(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 44327890 | 140880 | 0 | None | 46 | 3 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL384052 | 140880 | 0 | None | 46 | 3 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 44327656 | 141257 | 0 | None | 1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 977 | 25 | 9 | 8 | 4.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(F)(F)F)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL386181 | 141257 | 0 | None | 1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 977 | 25 | 9 | 8 | 4.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(F)(F)F)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11421972 | 206110 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(OC(F)(F)F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96422 | 206110 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cccc(OC(F)(F)F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 345351 | 9269 | 1 | None | -33 | 3 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| CHEMBL11131 | 9269 | 1 | None | -33 | 3 | Human | 4.5 | pIC50 | = | 4.5 | Functional | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| 11455999 | 206094 | 0 | None | -31 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 580 | 7 | 2 | 4 | 6.6 | O=C(O)[C@@H](Oc1cccc(Cl)c1)[C@@]1(c2ccccc2)NCC(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL96325 | 206094 | 0 | None | -31 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 580 | 7 | 2 | 4 | 6.6 | O=C(O)[C@@H](Oc1cccc(Cl)c1)[C@@]1(c2ccccc2)NCC(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 | 10.1021/jm031115r | ||
| 10282008 | 205352 | 0 | None | -12 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(OC(F)(F)F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL91873 | 205352 | 0 | None | -12 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(OC(F)(F)F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11364770 | 163104 | 0 | None | -5 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)c(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL420435 | 163104 | 0 | None | -5 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)c(F)c3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11191999 | 205766 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)ccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94438 | 205766 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 544 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)ccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11168474 | 206168 | 0 | None | -9 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96723 | 206168 | 0 | None | -9 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11308052 | 112168 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 618 | 10 | 2 | 6 | 5.8 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL330354 | 112168 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 618 | 10 | 2 | 6 | 5.8 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 11330570 | 205850 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 570 | 8 | 2 | 7 | 4.5 | COc1ccc(CN2C(=O)CN[C@](c3ccc(F)c(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL94934 | 205850 | 0 | None | -4 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 570 | 8 | 2 | 7 | 4.5 | COc1ccc(CN2C(=O)CN[C@](c3ccc(F)c(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11432855 | 206118 | 0 | None | -28 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 552 | 8 | 3 | 7 | 3.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(=O)O)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96463 | 206118 | 0 | None | -28 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 552 | 8 | 3 | 7 | 3.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(=O)O)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11444738 | 164327 | 0 | None | -4 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 594 | 11 | 2 | 7 | 5.4 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3ccc(OC)cc3)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL422068 | 164327 | 0 | None | -4 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 594 | 11 | 2 | 7 | 5.4 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3ccc(OC)cc3)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 44327347 | 96315 | 0 | None | 3 | 3 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL264579 | 96315 | 0 | None | 3 | 3 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11235126 | 206189 | 0 | None | -52 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 405 | 5 | 2 | 6 | 2.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCCOc3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96831 | 206189 | 0 | None | -52 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 405 | 5 | 2 | 6 | 2.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCCOc3ccccc32)n1 | 10.1021/jm031115r | ||
| 11786120 | 168602 | 0 | None | -17 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 546 | 7 | 2 | 4 | 5.9 | O=C(O)[C@@H](Oc1ccccc1)[C@@]1(c2ccccc2)NCC(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL440507 | 168602 | 0 | None | -17 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 546 | 7 | 2 | 4 | 5.9 | O=C(O)[C@@H](Oc1ccccc1)[C@@]1(c2ccccc2)NCC(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 | 10.1021/jm031115r | ||
| 11409474 | 205826 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 10 | 2 | 6 | 4.4 | CCCCCCN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2nc(C)cc(C)n2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL94810 | 205826 | 0 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 10 | 2 | 6 | 4.4 | CCCCCCN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2nc(C)cc(C)n2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| 9845562 | 4673 | 0 | None | -7 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(C)cc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL10374 | 4673 | 0 | None | -7 | 3 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(C)cc2)cc1 | 10.1021/jm00008a002 | ||
| 11330927 | 205774 | 0 | None | -8 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 606 | 9 | 2 | 6 | 5.9 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL94488 | 205774 | 0 | None | -8 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 606 | 9 | 2 | 6 | 5.9 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 44283270 | 167318 | 0 | None | -1 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL431124 | 167318 | 0 | None | -1 | 4 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 44327881 | 161126 | 0 | None | 2 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1044 | 26 | 9 | 8 | 6.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL413179 | 161126 | 0 | None | 2 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 1044 | 26 | 9 | 8 | 6.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 23670447 | 2980 | 2 | None | -501 | 4 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm00008a002 | ||
| 999 | 2980 | 2 | None | -501 | 4 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm00008a002 | ||
| CHEMBL1204799 | 2980 | 2 | None | -501 | 4 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm00008a002 | ||
| CHEMBL25438 | 2980 | 2 | None | -501 | 4 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm00008a002 | ||
| 9807691 | 99602 | 0 | None | -134 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL287169 | 99602 | 0 | None | -134 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 9845562 | 4673 | 0 | None | -87 | 3 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(C)cc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL10374 | 4673 | 0 | None | -87 | 3 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(C)cc2)cc1 | 10.1021/jm00008a002 | ||
| 9865706 | 97682 | 0 | None | -1 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 4.1 | Cc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL273613 | 97682 | 0 | None | -1 | 2 | Rat | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 4.1 | Cc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| 11742628 | 97783 | 0 | None | -234 | 3 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL274383 | 97783 | 0 | None | -234 | 3 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| 10166981 | 205359 | 0 | None | -2 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(F)(F)F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL91926 | 205359 | 0 | None | -2 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(C(F)(F)F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11283571 | 205864 | 0 | None | -7 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 508 | 7 | 2 | 6 | 4.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL95013 | 205864 | 0 | None | -7 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 508 | 7 | 2 | 6 | 4.0 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11477664 | 167604 | 0 | None | -6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 506 | 10 | 2 | 8 | 2.4 | COCCOCN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2nc(C)cc(C)n2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL433173 | 167604 | 0 | None | -6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 506 | 10 | 2 | 8 | 2.4 | COCCOCN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2nc(C)cc(C)n2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| 11408654 | 206198 | 0 | None | -19 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 464 | 7 | 2 | 8 | 1.8 | COc1cc(OC)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96906 | 206198 | 0 | None | -19 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 464 | 7 | 2 | 8 | 1.8 | COc1cc(OC)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10230703 | 206123 | 0 | None | -4 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96472 | 206123 | 0 | None | -4 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 542 | 7 | 2 | 6 | 4.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 9870830 | 204987 | 34 | None | -776 | 4 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL8981 | 204987 | 34 | None | -776 | 4 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm00008a002 | ||
| 11307457 | 205877 | 0 | None | -5 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 556 | 8 | 2 | 7 | 4.2 | COc1ccc(CN2C(=O)CN[C@](c3cccc(F)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL95095 | 205877 | 0 | None | -5 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 556 | 8 | 2 | 7 | 4.2 | COc1ccc(CN2C(=O)CN[C@](c3cccc(F)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11785813 | 106439 | 0 | None | -8 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL314755 | 106439 | 0 | None | -8 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 526 | 7 | 2 | 6 | 4.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10209814 | 205540 | 0 | None | -7 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)c(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL93084 | 205540 | 0 | None | -7 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(F)c(F)c3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11284285 | 106845 | 0 | None | -8 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 552 | 8 | 2 | 7 | 4.3 | COc1ccc(CN2C(=O)CN[C@](c3cccc(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL317510 | 106845 | 0 | None | -8 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 552 | 8 | 2 | 7 | 4.3 | COc1ccc(CN2C(=O)CN[C@](c3cccc(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11742628 | 97783 | 0 | None | -25 | 3 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL274383 | 97783 | 0 | None | -25 | 3 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm00008a002 | ||
| 10070783 | 96609 | 0 | None | -3 | 3 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| CHEMBL267094 | 96609 | 0 | None | -3 | 3 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm00008a002 | ||
| 11490160 | 205768 | 0 | None | -5 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 584 | 8 | 2 | 6 | 5.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(-c4ccccc4)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94446 | 205768 | 0 | None | -5 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 584 | 8 | 2 | 6 | 5.7 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccc(-c4ccccc4)cc3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11432418 | 106465 | 0 | None | -6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL314946 | 106465 | 0 | None | -6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10140418 | 105720 | 0 | None | -43 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 476 | 7 | 3 | 7 | 1.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC(=O)O)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL313867 | 105720 | 0 | None | -43 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 476 | 7 | 3 | 7 | 1.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC(=O)O)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 44327585 | 161234 | 0 | None | 14 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 992 | 26 | 9 | 8 | 5.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL414082 | 161234 | 0 | None | 14 | 2 | Rat | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 992 | 26 | 9 | 8 | 5.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11167889 | 206100 | 0 | None | -1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 496 | 7 | 2 | 6 | 3.7 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(Cl)ccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96351 | 206100 | 0 | None | -1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 496 | 7 | 2 | 6 | 3.7 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(Cl)ccc32)c1 | 10.1021/jm031115r | ||
| 10347783 | 206099 | 0 | None | -32 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 5.6 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96347 | 206099 | 0 | None | -32 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 5.6 | Cc1cc(C)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 1009 | 192 | 20 | None | 2238 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.6019/CHEMBL4507261 | ||
| 5310991 | 192 | 20 | None | 2238 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.6019/CHEMBL4507261 | ||
| CHEMBL332794 | 192 | 20 | None | 2238 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.6019/CHEMBL4507261 | ||
| 9894443 | 112081 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL330104 | 112081 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 576 | 7 | 2 | 6 | 5.3 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11385689 | 112299 | 0 | None | -10 | 2 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 462 | 7 | 2 | 6 | 3.0 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL330629 | 112299 | 0 | None | -10 | 2 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 462 | 7 | 2 | 6 | 3.0 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 10163956 | 205855 | 0 | None | -10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 500 | 7 | 3 | 9 | 1.5 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3nn[nH]n3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL94964 | 205855 | 0 | None | -10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 500 | 7 | 3 | 9 | 1.5 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3nn[nH]n3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11224973 | 106964 | 0 | None | -32 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 460 | 7 | 2 | 6 | 2.9 | CCc1cc(CC)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL318270 | 106964 | 0 | None | -32 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 460 | 7 | 2 | 6 | 2.9 | CCc1cc(CC)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11353580 | 206200 | 0 | None | -21 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 566 | 9 | 2 | 7 | 4.6 | CCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3ccc(OC)cc3)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL96932 | 206200 | 0 | None | -21 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 566 | 9 | 2 | 7 | 4.6 | CCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3ccc(OC)cc3)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 11156692 | 167313 | 0 | None | -2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL431087 | 167313 | 0 | None | -2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 522 | 7 | 2 | 6 | 4.3 | Cc1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11204331 | 112087 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 616 | 10 | 2 | 6 | 6.1 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL330135 | 112087 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 616 | 10 | 2 | 6 | 6.1 | CCCCc1cccc([C@]2([C@H](Oc3nc(C)cc(C)n3)C(=O)O)NCC(=O)N(Cc3c(F)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| 10303311 | 106678 | 0 | None | -9 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 566 | 8 | 2 | 8 | 3.8 | COC(=O)c1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL316301 | 106678 | 0 | None | -9 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 566 | 8 | 2 | 8 | 3.8 | COC(=O)c1ccc(CN2C(=O)CN[C@](c3ccccc3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11202819 | 112072 | 0 | None | -1 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 499 | 6 | 3 | 8 | 3.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3c(C(=O)O)nc(C)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL330045 | 112072 | 0 | None | -1 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 499 | 6 | 3 | 8 | 3.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCc3c(C(=O)O)nc(C)n3-c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11478553 | 162898 | 0 | None | -10 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)c(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL419879 | 162898 | 0 | None | -10 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3cc(F)c(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11744509 | 5358 | 0 | None | -5 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 450 | 5 | 1 | 6 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(Cl)cc2)cc1 | 10.1021/jm00008a002 | ||
| CHEMBL10733 | 5358 | 0 | None | -5 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 450 | 5 | 1 | 6 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(Cl)cc2)cc1 | 10.1021/jm00008a002 | ||
| 11307120 | 111911 | 0 | None | 4 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 532 | 11 | 2 | 7 | 4.5 | CCCCC[C@]1([C@H](Oc2nc(C)cc(C)n2)C(=O)O)NCC(=O)N(Cc2ccc(OC)cc2)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL329744 | 111911 | 0 | None | 4 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 532 | 11 | 2 | 7 | 4.5 | CCCCC[C@]1([C@H](Oc2nc(C)cc(C)n2)C(=O)O)NCC(=O)N(Cc2ccc(OC)cc2)c2ccccc21 | 10.1021/jm031115r | ||
| 11456110 | 206104 | 0 | None | 1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3OC(F)(F)F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96387 | 206104 | 0 | None | 1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 592 | 8 | 2 | 7 | 4.9 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3ccccc3OC(F)(F)F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 18995989 | 100089 | 0 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 583 | 9 | 1 | 9 | 6.6 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL29147 | 100089 | 0 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 583 | 9 | 1 | 9 | 6.6 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00232-6 | ||
| 11318559 | 206067 | 0 | None | -5 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 531 | 8 | 2 | 8 | 2.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCN3CCOCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96193 | 206067 | 0 | None | -5 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 531 | 8 | 2 | 8 | 2.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CCN3CCOCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11410410 | 205816 | 0 | None | -25 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 6.2 | Cc1cccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL94769 | 205816 | 0 | None | -25 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 6.2 | Cc1cccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL413825 | 211339 | 0 | None | 4 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(95)00084-7 | ||||
| 11489946 | 205616 | 0 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 566 | 8 | 2 | 7 | 4.6 | COc1ccc(CN2C(=O)CN[C@](c3cc(C)cc(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL93612 | 205616 | 0 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 566 | 8 | 2 | 7 | 4.6 | COc1ccc(CN2C(=O)CN[C@](c3cc(C)cc(C)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11785180 | 111020 | 0 | None | -1 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 492 | 8 | 2 | 7 | 3.1 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(OC)ccc32)c1 | 10.1021/jm031115r | ||
| CHEMBL327823 | 111020 | 0 | None | -1 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 492 | 8 | 2 | 7 | 3.1 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(OC)ccc32)c1 | 10.1021/jm031115r | ||
| 11238500 | 206089 | 0 | None | -3 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 572 | 8 | 2 | 7 | 4.7 | COc1ccc(CN2C(=O)CN[C@](c3cccc(Cl)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL96313 | 206089 | 0 | None | -3 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 572 | 8 | 2 | 7 | 4.7 | COc1ccc(CN2C(=O)CN[C@](c3cccc(Cl)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11441050 | 206096 | 0 | None | -85 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 403 | 5 | 2 | 5 | 3.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCCCc3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96331 | 206096 | 0 | None | -85 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 403 | 5 | 2 | 5 | 3.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCCCc3ccccc32)n1 | 10.1021/jm031115r | ||
| 11398818 | 167368 | 0 | None | -2 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 556 | 8 | 2 | 7 | 4.2 | COc1ccc(CN2C(=O)CN[C@](c3ccccc3F)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL431460 | 167368 | 0 | None | -2 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 556 | 8 | 2 | 7 | 4.2 | COc1ccc(CN2C(=O)CN[C@](c3ccccc3F)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11168401 | 111812 | 0 | None | -18 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 522 | 9 | 2 | 8 | 3.1 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(OC)c(OC)cc32)c1 | 10.1021/jm031115r | ||
| CHEMBL329132 | 111812 | 0 | None | -18 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 522 | 9 | 2 | 8 | 3.1 | COc1cc(OC)cc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3cc(OC)c(OC)cc32)c1 | 10.1021/jm031115r | ||
| 11489174 | 112056 | 0 | None | 1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 514 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC3CCCCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL329943 | 112056 | 0 | None | 1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 514 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC3CCCCC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 10166543 | 111870 | 0 | None | -33 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL329477 | 111870 | 0 | None | -33 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 562 | 7 | 2 | 6 | 4.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11387934 | 106693 | 0 | None | -28 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 614 | 9 | 2 | 7 | 5.7 | COc1ccc(CN2C(=O)CN[C@](c3cccc(-c4ccccc4)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL316453 | 106693 | 0 | None | -28 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 614 | 9 | 2 | 7 | 5.7 | COc1ccc(CN2C(=O)CN[C@](c3cccc(-c4ccccc4)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11157599 | 162931 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 588 | 8 | 2 | 4 | 7.0 | CC(C)c1ccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL420072 | 162931 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 588 | 8 | 2 | 4 | 7.0 | CC(C)c1ccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11155687 | 206092 | 0 | None | -12 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 472 | 7 | 2 | 6 | 3.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC3CC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL96318 | 206092 | 0 | None | -12 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 472 | 7 | 2 | 6 | 3.2 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(CC3CC3)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 11377200 | 107812 | 0 | None | -11 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 638 | 8 | 2 | 6 | 6.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3cccc(-c4ccccc4)c3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| CHEMBL319754 | 107812 | 0 | None | -11 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 638 | 8 | 2 | 6 | 6.1 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3cccc(-c4ccccc4)c3)NCC(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc32)n1 | 10.1021/jm031115r | ||
| 44327466 | 96004 | 0 | None | 16 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 966 | 25 | 9 | 8 | 5.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL262229 | 96004 | 0 | None | 16 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 966 | 25 | 9 | 8 | 5.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11477084 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| 216235 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| 3548 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| 3950 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| CHEMBL282724 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| DB06268 | 3553 | 46 | None | -20 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm030528p | ||
| CHEMBL319537 | 209473 | 0 | None | -2 | 2 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | 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)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 11362537 | 107035 | 0 | None | -24 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 434 | 6 | 2 | 7 | 1.8 | COc1cnc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)nc1 | 10.1021/jm031115r | ||
| CHEMBL318683 | 107035 | 0 | None | -24 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 434 | 6 | 2 | 7 | 1.8 | COc1cnc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)nc1 | 10.1021/jm031115r | ||
| 44327348 | 161358 | 0 | None | -1 | 2 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 1076 | 28 | 9 | 8 | 7.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL415238 | 161358 | 0 | None | -1 | 2 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 1076 | 28 | 9 | 8 | 7.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL407933 | 210947 | 0 | None | -1 | 2 | Rat | 5.0 | pIC50 | = | 5.0 | Functional | 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](NC(=O)NC1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 11342089 | 106724 | 0 | None | -9 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 568 | 9 | 2 | 8 | 4.0 | COc1ccc(CN2C(=O)CN[C@](c3cccc(OC)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL316629 | 106724 | 0 | None | -9 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 568 | 9 | 2 | 8 | 4.0 | COc1ccc(CN2C(=O)CN[C@](c3cccc(OC)c3)([C@H](Oc3nc(C)cc(C)n3)C(=O)O)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 11488556 | 206133 | 0 | None | -10 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 482 | 5 | 2 | 6 | 2.6 | CN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2ncc(Br)cn2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| CHEMBL96520 | 206133 | 0 | None | -10 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 482 | 5 | 2 | 6 | 2.6 | CN1C(=O)CN[C@](c2ccccc2)([C@H](Oc2ncc(Br)cn2)C(=O)O)c2ccccc21 | 10.1021/jm031115r | ||
| 11226767 | 205793 | 0 | None | -6 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 6.2 | Cc1ccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| CHEMBL94606 | 205793 | 0 | None | -6 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 560 | 7 | 2 | 4 | 6.2 | Cc1ccc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 | 10.1021/jm031115r | ||
| 9809919 | 202704 | 0 | None | - | 2 | Rat | 6.0 | pKd | = | 6 | Functional | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL72037 | 202704 | 0 | None | - | 2 | Rat | 6.0 | pKd | = | 6 | Functional | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 18184194 | 130040 | 0 | None | - | 2 | Rat | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 712 | 15 | 2 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368107 | 130040 | 0 | None | - | 2 | Rat | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 712 | 15 | 2 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9831249 | 59385 | 0 | None | - | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 672 | 14 | 2 | 10 | 6.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172297 | 59385 | 0 | None | - | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 672 | 14 | 2 | 10 | 6.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9985589 | 167680 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 576 | 9 | 1 | 8 | 5.0 | CCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL433700 | 167680 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 576 | 9 | 1 | 8 | 5.0 | CCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| 104865 | 698 | 94 | None | -11 | 5 | Rat | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 3494 | 698 | 94 | None | -11 | 5 | Rat | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 392 | 698 | 94 | None | -11 | 5 | Rat | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL957 | 698 | 94 | None | -11 | 5 | Rat | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| DB00559 | 698 | 94 | None | -11 | 5 | Rat | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 9848132 | 205843 | 0 | None | - | 2 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94918 | 205843 | 0 | None | - | 2 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 9961131 | 131635 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 650 | 15 | 2 | 12 | 3.1 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL369676 | 131635 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 650 | 15 | 2 | 12 | 3.1 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9809919 | 202704 | 0 | None | - | 2 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL72037 | 202704 | 0 | None | - | 2 | Rat | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 9809270 | 130818 | 0 | None | - | 2 | Rat | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 622 | 14 | 2 | 12 | 2.3 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368738 | 130818 | 0 | None | - | 2 | Rat | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 622 | 14 | 2 | 12 | 2.3 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9873255 | 59322 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 591 | 14 | 2 | 10 | 3.8 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172071 | 59322 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 591 | 14 | 2 | 10 | 3.8 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 18184234 | 61880 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL177802 | 61880 | 0 | None | - | 2 | Rat | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9807691 | 99602 | 0 | None | -134 | 2 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL287169 | 99602 | 0 | None | -134 | 2 | Human | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 9810571 | 61057 | 0 | None | - | 2 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 731 | 18 | 2 | 13 | 5.0 | CCCS(=O)(=O)NCCOc1nc(-c2cc(OC)c(OC)c(OC)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL176997 | 61057 | 0 | None | - | 2 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 731 | 18 | 2 | 13 | 5.0 | CCCS(=O)(=O)NCCOc1nc(-c2cc(OC)c(OC)c(OC)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9897092 | 59621 | 0 | None | - | 2 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 779 | 17 | 2 | 13 | 6.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL173201 | 59621 | 0 | None | - | 2 | Rat | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 779 | 17 | 2 | 13 | 6.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 18184229 | 59296 | 0 | None | - | 2 | Rat | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL171950 | 59296 | 0 | None | - | 2 | Rat | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9853680 | 98195 | 0 | None | - | 2 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 771 | 17 | 2 | 14 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL277275 | 98195 | 0 | None | - | 2 | Rat | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 771 | 17 | 2 | 14 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9830773 | 129704 | 0 | None | - | 2 | Rat | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 636 | 14 | 2 | 12 | 2.8 | CCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367958 | 129704 | 0 | None | - | 2 | Rat | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 636 | 14 | 2 | 12 | 2.8 | CCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9874557 | 129216 | 0 | None | - | 2 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 667 | 15 | 2 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367443 | 129216 | 0 | None | - | 2 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 667 | 15 | 2 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9831527 | 128960 | 0 | None | - | 2 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 698 | 14 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367274 | 128960 | 0 | None | - | 2 | Rat | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 698 | 14 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9957883 | 98204 | 0 | None | -25 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL27732 | 98204 | 0 | None | -25 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 18995992 | 99377 | 0 | None | -3 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28563 | 99377 | 0 | None | -3 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 9917072 | 61774 | 0 | None | - | 2 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 619 | 16 | 2 | 10 | 4.6 | CCCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL177538 | 61774 | 0 | None | - | 2 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 619 | 16 | 2 | 10 | 4.6 | CCCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9853077 | 59315 | 0 | None | - | 2 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 696 | 13 | 2 | 12 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172030 | 59315 | 0 | None | - | 2 | Rat | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 696 | 13 | 2 | 12 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9917706 | 129217 | 0 | None | - | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367444 | 129217 | 0 | None | - | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 13016 | 663 | 9 | None | - | 0 | Human | 4.7 | pKi | = | 4.7 | Functional | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm030480f | ||
| 9843631 | 663 | 9 | None | - | 0 | Human | 4.7 | pKi | = | 4.7 | Functional | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm030480f | ||
| CHEMBL24461 | 663 | 9 | None | - | 0 | Human | 4.7 | pKi | = | 4.7 | Functional | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm030480f | ||
| 10096179 | 176446 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 468 | 9 | 1 | 5 | 5.7 | CCOc1ccc(-c2cc(C)nc(OC(C(=O)O)C(C)(c3ccccc3)c3ccccc3)n2)cc1 | 10.1016/s0960-894x(03)00236-1 | ||
| CHEMBL46311 | 176446 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 468 | 9 | 1 | 5 | 5.7 | CCOc1ccc(-c2cc(C)nc(OC(C(=O)O)C(C)(c3ccccc3)c3ccccc3)n2)cc1 | 10.1016/s0960-894x(03)00236-1 | ||
| 10070 | 445 | 41 | None | -109 | 2 | Human | 5.5 | pA2 | = | 5.5 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| 25099191 | 445 | 41 | None | -109 | 2 | Human | 5.5 | pA2 | = | 5.5 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| CHEMBL2165326 | 445 | 41 | None | -109 | 2 | Human | 5.5 | pA2 | = | 5.5 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| DB15059 | 445 | 41 | None | -109 | 2 | Human | 5.5 | pA2 | = | 5.5 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| 104865 | 698 | 94 | None | -11 | 5 | Rat | 6.0 | pA2 | = | 6 | Functional | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 3494 | 698 | 94 | None | -11 | 5 | Rat | 6.0 | pA2 | = | 6 | Functional | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 392 | 698 | 94 | None | -11 | 5 | Rat | 6.0 | pA2 | = | 6 | Functional | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| CHEMBL957 | 698 | 94 | None | -11 | 5 | Rat | 6.0 | pA2 | = | 6 | Functional | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| DB00559 | 698 | 94 | None | -11 | 5 | Rat | 6.0 | pA2 | = | 6 | Functional | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 3913 | 3680 | 0 | None | 1 | 2 | Rat | 8.4 | pA2 | = | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 7780649 | ||||
| 5311469 | 3680 | 0 | None | 1 | 2 | Rat | 8.4 | pA2 | = | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 7780649 | ||||
| 104865 | 698 | 94 | None | -11 | 5 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 3494 | 698 | 94 | None | -11 | 5 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 392 | 698 | 94 | None | -11 | 5 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| CHEMBL957 | 698 | 94 | None | -11 | 5 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| DB00559 | 698 | 94 | None | -11 | 5 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 3951 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 15139756 | ||
| 4337 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 15139756 | ||
| 6918493 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 15139756 | ||
| CHEMBL1111 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 15139756 | ||
| DB06403 | 388 | 82 | None | -47 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 15139756 | ||
| 10070 | 445 | 41 | None | -109 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| 25099191 | 445 | 41 | None | -109 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| CHEMBL2165326 | 445 | 41 | None | -109 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| DB15059 | 445 | 41 | None | -109 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | Guide to Pharmacology | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 18780830 | ||
| 16004692 | 2421 | 85 | None | -107 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 22862294 | ||
| 4809 | 2421 | 85 | None | -107 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 22862294 | ||
| 7352 | 2421 | 85 | None | -107 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 22862294 | ||
| CHEMBL2103873 | 2421 | 85 | None | -107 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 22862294 | ||
| DB08932 | 2421 | 85 | None | -107 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 22862294 | ||
| 1011 | 3300 | 24 | None | 102 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 8612786 | ||
| 5312146 | 3300 | 24 | None | 102 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 8612786 | ||
| CHEMBL1628620 | 3300 | 24 | None | 102 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 8612786 | ||
| 3911 | 3265 | 0 | None | 501 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 8183252 | ||||
| CHEMBL429908 | 3265 | 0 | None | 501 | 2 | Human | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 8183252 | ||||
| 9651 | 2143 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | 682 | 12 | 2 | 10 | 6.9 | COc1ccccc1Oc1c(OCCC(=O)Nc2c(C)cccc2C)nc(nc1NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 28805809 | ||
| 9810112 | 2143 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | 682 | 12 | 2 | 10 | 6.9 | COc1ccccc1Oc1c(OCCC(=O)Nc2c(C)cccc2C)nc(nc1NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 28805809 | ||
| 108002 | 3438 | 14 | None | 1 | 2 | Rat | 9.4 | pKB | = | 9.4 | Functional | Guide to Pharmacology | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 8201588 | ||
| 3528 | 3438 | 14 | None | 1 | 2 | Rat | 9.4 | pKB | = | 9.4 | Functional | Guide to Pharmacology | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 8201588 | ||
| CHEMBL8823 | 3438 | 14 | None | 1 | 2 | Rat | 9.4 | pKB | = | 9.4 | Functional | Guide to Pharmacology | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 8201588 | ||
| 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 |
| CHEMBL2370066 | 208032 | 0 | None | - | 0 | Rat | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN)NC(=O)[C@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL2370067 | 208033 | 0 | None | - | 0 | Rat | 5.7 | pEC50 | = | 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](N)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C=O)Cc1c[nH]c2ccccc12)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL315841 | 209447 | 0 | None | - | 0 | Rat | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00070a001 | ||||
| CHEMBL407269 | 210904 | 0 | None | - | 0 | Rat | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL387200 | 210661 | 0 | None | - | 0 | Rat | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL86703 | 214112 | 0 | None | - | 0 | Rat | 5.2 | pEC50 | = | 5.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C | 10.1021/jm00070a001 | ||||
| CHEMBL313344 | 209366 | 0 | None | - | 0 | Rat | 5.2 | pEC50 | = | 5.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL1790180 | 207140 | 0 | None | -1 | 3 | Human | 10.5 | pIC50 | = | 10.5 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.ejmech.2013.01.044 | ||||
| CHEMBL1790180 | 207140 | 0 | None | -1 | 3 | Human | 10.4 | pIC50 | = | 10.4 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.bmc.2013.03.016 | ||||
| CHEMBL1790180 | 207140 | 0 | None | -1 | 3 | Human | 10.0 | pIC50 | = | 10.0 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm8007618 | ||||
| CHEMBL438733 | 212043 | 0 | None | - | 0 | Bovine | 10.0 | pIC50 | = | 10.0 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H]2CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N2)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00077a013 | ||||
| 44284481 | 211977 | 0 | None | - | 5 | Bovine | 9.9 | pIC50 | = | 9.9 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00077a013 | ||||
| CHEMBL437472 | 211977 | 0 | None | - | 5 | Bovine | 9.9 | pIC50 | = | 9.9 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00077a013 | ||||
| 44284481 | 211977 | 0 | None | -4 | 5 | Human | 9.9 | pIC50 | = | 9.9 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.bmcl.2013.01.025 | ||||
| CHEMBL437472 | 211977 | 0 | None | -4 | 5 | Human | 9.9 | pIC50 | = | 9.9 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.bmcl.2013.01.025 | ||||
| 10603409 | 110115 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL325581 | 110115 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL1790962 | 207167 | 0 | None | - | 1 | Bovine | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)[C@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00077a013 | ||||
| CHEMBL427748 | 211624 | 0 | None | - | 0 | Bovine | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00077a013 | ||||
| 10603409 | 110115 | 0 | None | - | 0 | Pig | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL325581 | 110115 | 0 | None | - | 0 | Pig | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| 10651488 | 162827 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| CHEMBL419367 | 162827 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| 44284481 | 211977 | 0 | None | -4 | 5 | Human | 9.7 | pIC50 | = | 9.7 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00400-9 | ||||
| CHEMBL437472 | 211977 | 0 | None | -4 | 5 | Human | 9.7 | pIC50 | = | 9.7 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00400-9 | ||||
| CHEMBL2165327 | 207587 | 7 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC2=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm3009103 | ||||
| CHEMBL263855 | 208849 | 0 | None | - | 0 | Bovine | 9.6 | pIC50 | = | 9.6 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2c[nH]cn2)C(=O)NCC(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N2CCC[C@@H]2C(=O)N1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL2373292 | 208630 | 0 | None | - | 1 | Bovine | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00077a013 | ||||
| 10839947 | 116799 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL339657 | 116799 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 9916235 | 9263 | 1 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL111277 | 9263 | 1 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 9916235 | 9263 | 1 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL111277 | 9263 | 1 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10187997 | 109484 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL323464 | 109484 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10651488 | 162827 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| CHEMBL419367 | 162827 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| CHEMBL1790963 | 207168 | 0 | None | - | 0 | Bovine | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00077a013 | ||||
| 10210629 | 8676 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL109644 | 8676 | 0 | None | - | 0 | Pig | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL2373291 | 208629 | 0 | None | - | 1 | Bovine | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00077a013 | ||||
| CHEMBL411171 | 211120 | 0 | None | - | 1 | Bovine | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00077a013 | ||||
| 10187997 | 109484 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL323464 | 109484 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10210629 | 8676 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL109644 | 8676 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10555806 | 12016 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 616 | 12 | 2 | 7 | 6.0 | CC(C)OCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184095 | 12016 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 616 | 12 | 2 | 7 | 6.0 | CC(C)OCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL332289 | 12016 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 616 | 12 | 2 | 7 | 6.0 | CC(C)OCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| 1009 | 192 | 20 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| 5310991 | 192 | 20 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| CHEMBL332794 | 192 | 20 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| 10792711 | 114293 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 548 | 9 | 2 | 6 | 5.2 | CCc1cc(F)cc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL333972 | 114293 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 548 | 9 | 2 | 6 | 5.2 | CCc1cc(F)cc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 44314619 | 202980 | 0 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL73925 | 202980 | 0 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL284250 | 209115 | 0 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1016/0960-894X(95)00237-N | ||||
| 9916235 | 9263 | 1 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL111277 | 9263 | 1 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 578 | 14 | 1 | 7 | 4.6 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10816963 | 112830 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 574 | 12 | 2 | 7 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC)cc1 | 10.1021/jm990170q | ||
| CHEMBL331625 | 112830 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 574 | 12 | 2 | 7 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC)cc1 | 10.1021/jm990170q | ||
| 9896468 | 170102 | 0 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 703 | 13 | 2 | 10 | 6.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCCC(=O)Nc1ccccc1C(C)C | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4451582 | 170102 | 0 | None | - | 0 | Pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 703 | 13 | 2 | 10 | 6.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCCC(=O)Nc1ccccc1C(C)C | 10.1016/j.bmcl.2016.06.014 | ||
| 10626362 | 11346 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 544 | 8 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180351 | 11346 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 544 | 8 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL123316 | 11346 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 544 | 8 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| 10651488 | 162827 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| CHEMBL419367 | 162827 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 618 | 13 | 1 | 7 | 4.8 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCC(F)(F)F | 10.1021/jm970101g | ||
| 10187997 | 109484 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL323464 | 109484 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 564 | 13 | 1 | 7 | 4.2 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10603409 | 110115 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL325581 | 110115 | 0 | None | - | 0 | Pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 584 | 13 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| 10698065 | 12007 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.6 | CCC(CC)C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL1184065 | 12007 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.6 | CCC(CC)C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL330895 | 12007 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.6 | CCC(CC)C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| 10841170 | 12013 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184090 | 12013 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL332109 | 12013 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| 44314619 | 202980 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL73925 | 202980 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| 10816963 | 112830 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 574 | 12 | 2 | 7 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC)cc1 | 10.1021/jm990170q | ||
| CHEMBL331625 | 112830 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 574 | 12 | 2 | 7 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC)cc1 | 10.1021/jm990170q | ||
| 10167052 | 109151 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 578 | 13 | 1 | 7 | 4.5 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCC(C)C | 10.1021/jm970101g | ||
| CHEMBL322297 | 109151 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 578 | 13 | 1 | 7 | 4.5 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CCC(C)C | 10.1021/jm970101g | ||
| 137630807 | 160565 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cc2ccccc2n1C(=O)OC)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4075238 | 160565 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cc2ccccc2n1C(=O)OC)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4117106 | 160565 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@@H](NC(=O)[C@@H](Cc1cc2ccccc2n1C(=O)OC)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/j.bmcl.2017.04.049 | ||
| 10792636 | 167950 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(CC)cccc2CC)cc1 | 10.1021/jm990170q | ||
| CHEMBL435385 | 167950 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(CC)cccc2CC)cc1 | 10.1021/jm990170q | ||
| CHEMBL2370534 | 208124 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=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](Cc2c[nH]cn2)NC(=O)[C@H](N)Cc2ccccc2)C(C)C)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm990170q | ||||
| 155560344 | 175929 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL4568795 | 175929 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL4596821 | 175929 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@@H](CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/acs.jmedchem.5b01781 | ||
| 44283453 | 138248 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)C(CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL37807 | 138248 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 641 | 12 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)C(CC(C)(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 44314620 | 102670 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 587 | 12 | 5 | 4 | 4.4 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL307903 | 102670 | 0 | None | - | 0 | Pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 587 | 12 | 5 | 4 | 4.4 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| 3887 | 2041 | 39 | None | -7 | 4 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01781 | ||||
| 5311192 | 2041 | 39 | None | -7 | 4 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01781 | ||||
| CHEMBL72410 | 2041 | 39 | None | -7 | 4 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01781 | ||||
| 10839947 | 116799 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL339657 | 116799 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 5.0 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 10210629 | 8676 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL109644 | 8676 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm970101g | ||
| 10792934 | 163361 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 558 | 10 | 2 | 6 | 5.6 | CCc1cc(CC)c(NC(=O)CN2C[C@H](c3ccc4c(c3)OCO4)[C@@H](C(=O)O)[C@@H]2c2ccc(OC)cc2)c(CC)c1 | 10.1021/jm990170q | ||
| CHEMBL420729 | 163361 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 558 | 10 | 2 | 6 | 5.6 | CCc1cc(CC)c(NC(=O)CN2C[C@H](c3ccc4c(c3)OCO4)[C@@H](C(=O)O)[C@@H]2c2ccc(OC)cc2)c(CC)c1 | 10.1021/jm990170q | ||
| 10120499 | 109268 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 564 | 12 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CC(C)C | 10.1021/jm970101g | ||
| CHEMBL323055 | 109268 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 564 | 12 | 1 | 7 | 4.1 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)CC(C)C | 10.1021/jm970101g | ||
| 44314472 | 103321 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 13 | 5 | 5 | 4.2 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL309003 | 103321 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 13 | 5 | 5 | 4.2 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44284481 | 211977 | 0 | None | 3 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00095a029 | ||||
| CHEMBL437472 | 211977 | 0 | None | 3 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00095a029 | ||||
| 44283420 | 161243 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 13 | 5 | 5 | 4.2 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL414175 | 161243 | 0 | None | - | 0 | Pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 594 | 13 | 5 | 5 | 4.2 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 10604119 | 11352 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 636 | 12 | 2 | 7 | 5.8 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180361 | 11352 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 636 | 12 | 2 | 7 | 5.8 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL123654 | 11352 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 636 | 12 | 2 | 7 | 5.8 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| 9846994 | 105509 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 458 | 6 | 1 | 6 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL313153 | 105509 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 458 | 6 | 1 | 6 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44315008 | 102358 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL305524 | 102358 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 9961347 | 11857 | 1 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL1182945 | 11857 | 1 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL273642 | 11857 | 1 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| 44315007 | 202843 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 679 | 14 | 5 | 5 | 5.1 | CCCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL72891 | 202843 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 679 | 14 | 5 | 5 | 5.1 | CCCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL411057 | 211113 | 0 | None | - | 0 | Bovine | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| CHEMBL384792 | 210588 | 0 | None | - | 0 | Bovine | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL405599 | 210821 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| CHEMBL413825 | 211339 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(95)00084-7 | ||||
| 10627805 | 16402 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 630 | 7 | 2 | 6 | 5.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(Br)cccc2Br)cc1 | 10.1021/jm990170q | ||
| CHEMBL123926 | 16402 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 630 | 7 | 2 | 6 | 5.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(Br)cccc2Br)cc1 | 10.1021/jm990170q | ||
| 22004774 | 100342 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 442 | 8 | 1 | 6 | 5.7 | CCCCSC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL293192 | 100342 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 442 | 8 | 1 | 6 | 5.7 | CCCCSC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 10146305 | 173699 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 14 | 2 | 13 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2cccs2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4549357 | 173699 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 14 | 2 | 13 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2cccs2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44385008 | 130839 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 574 | 10 | 2 | 9 | 4.9 | C#CCOc1nc(-c2ccnc(CO)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368829 | 130839 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 574 | 10 | 2 | 9 | 4.9 | C#CCOc1nc(-c2ccnc(CO)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 44333867 | 4574 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 403 | 4 | 1 | 5 | 4.1 | COc1ccc([C@@H]2c3nc(C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL103001 | 4574 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 403 | 4 | 1 | 5 | 4.1 | COc1ccc([C@@H]2c3nc(C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44284196 | 100057 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 504 | 9 | 2 | 7 | 5.4 | CCCOc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL291247 | 100057 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 504 | 9 | 2 | 7 | 5.4 | CCCOc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| 9853025 | 59504 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 690 | 14 | 2 | 13 | 3.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172759 | 59504 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 690 | 14 | 2 | 13 | 3.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.8b00435 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.8b00435 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.8b00435 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.8b00435 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.8b00435 | ||
| CHEMBL407188 | 210898 | 0 | None | - | 0 | Bovine | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| 44284481 | 211977 | 0 | None | - | 5 | Bovine | 6.0 | pIC50 | = | 6 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL437472 | 211977 | 0 | None | - | 5 | Bovine | 6.0 | pIC50 | = | 6 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00296-5 | ||||
| 10814440 | 97695 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)ccc2OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL273723 | 97695 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)ccc2OC)cc1 | 10.1021/jm9606507 | ||
| 44279383 | 99532 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.2 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccccc3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL286687 | 99532 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.2 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccccc3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 122044 | 10078 | 47 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 473 | 9 | 2 | 8 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCO)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL115951 | 10078 | 47 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 473 | 9 | 2 | 8 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCO)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| 17869373 | 14465 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2cccc(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205094 | 14465 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2cccc(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL51890 | 14465 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2cccc(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44276969 | 106356 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 506 | 7 | 1 | 5 | 4.8 | COc1cccc(Cn2[nH]c(C(F)(F)C(F)(F)C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144607 | 106356 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 506 | 7 | 1 | 5 | 4.8 | COc1cccc(Cn2[nH]c(C(F)(F)C(F)(F)C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 44311225 | 203001 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 581 | 11 | 1 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)c1ccoc1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL74118 | 203001 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 581 | 11 | 1 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)c1ccoc1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL269428 | 209042 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | 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)C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 44267002 | 98107 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 546 | 5 | 1 | 7 | 5.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc3c2CCc2ccccc2C3=O)cc1 | 10.1021/jm9606507 | ||
| CHEMBL276601 | 98107 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 546 | 5 | 1 | 7 | 5.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc3c2CCc2ccccc2C3=O)cc1 | 10.1021/jm9606507 | ||
| 10552883 | 109516 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 484 | 13 | 1 | 5 | 4.8 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC=C1CC1 | 10.1021/jm980217s | ||
| CHEMBL323485 | 109516 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 484 | 13 | 1 | 5 | 4.8 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC=C1CC1 | 10.1021/jm980217s | ||
| 11100307 | 201511 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 354 | 5 | 1 | 5 | 3.8 | CCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL64340 | 201511 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 354 | 5 | 1 | 5 | 3.8 | CCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL289687 | 209130 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | 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]cn1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 10453733 | 111819 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 402 | 9 | 1 | 5 | 4.8 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2cccnc2)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL329181 | 111819 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 402 | 9 | 1 | 5 | 4.8 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2cccnc2)ccc1C#N | 10.1021/jm9707131 | ||
| 11797717 | 205332 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 448 | 10 | 2 | 5 | 6.0 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1cc[nH]n1 | 10.1021/jm9707131 | ||
| CHEMBL91753 | 205332 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 448 | 10 | 2 | 5 | 6.0 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1cc[nH]n1 | 10.1021/jm9707131 | ||
| 10668808 | 205432 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 402 | 9 | 1 | 5 | 4.8 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2ccncc2)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL92353 | 205432 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 402 | 9 | 1 | 5 | 4.8 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2ccncc2)ccc1C#N | 10.1021/jm9707131 | ||
| 10504148 | 205528 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 459 | 10 | 1 | 5 | 6.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1ccccn1 | 10.1021/jm9707131 | ||
| CHEMBL92965 | 205528 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 459 | 10 | 1 | 5 | 6.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1ccccn1 | 10.1021/jm9707131 | ||
| 10599453 | 205541 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 445 | 9 | 1 | 6 | 5.2 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2ccc3c(c2)OCO3)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL93097 | 205541 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 445 | 9 | 1 | 6 | 5.2 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2ccc3c(c2)OCO3)ccc1C#N | 10.1021/jm9707131 | ||
| 10740214 | 205573 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 408 | 9 | 1 | 6 | 4.9 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2cnsc2)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL93331 | 205573 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 408 | 9 | 1 | 6 | 4.9 | Cc1ccccc1[C@@H](CCC(=O)O)Oc1cc(OCc2cnsc2)ccc1C#N | 10.1021/jm9707131 | ||
| 10693679 | 205641 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 425 | 10 | 2 | 5 | 4.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C(N)=O | 10.1021/jm9707131 | ||
| CHEMBL93749 | 205641 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 425 | 10 | 2 | 5 | 4.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C(N)=O | 10.1021/jm9707131 | ||
| 11796594 | 205646 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 424 | 10 | 1 | 5 | 5.8 | CC(=O)c1ccc(OCc2ccsc2)cc1OC(CCC(=O)O)c1ccccc1C | 10.1021/jm9707131 | ||
| CHEMBL93776 | 205646 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 424 | 10 | 1 | 5 | 5.8 | CC(=O)c1ccc(OCc2ccsc2)cc1OC(CCC(=O)O)c1ccccc1C | 10.1021/jm9707131 | ||
| 10669120 | 205712 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 407 | 9 | 1 | 5 | 5.5 | Cc1ccccc1[C@H](CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL94141 | 205712 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 407 | 9 | 1 | 5 | 5.5 | Cc1ccccc1[C@H](CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C#N | 10.1021/jm9707131 | ||
| 10694804 | 206085 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 449 | 10 | 1 | 6 | 6.3 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1ncco1 | 10.1021/jm9707131 | ||
| CHEMBL96301 | 206085 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 449 | 10 | 1 | 6 | 6.3 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1ncco1 | 10.1021/jm9707131 | ||
| CHEMBL289687 | 209130 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | 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]cn1)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/jm00095a029 | ||||
| 137661460 | 158828 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 565 | 10 | 2 | 9 | 4.4 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4100579 | 158828 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 565 | 10 | 2 | 9 | 4.4 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 9852624 | 128159 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 14 | 2 | 11 | 4.5 | CCS(=O)(=O)NCCCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL366872 | 128159 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 656 | 14 | 2 | 11 | 4.5 | CCS(=O)(=O)NCCCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 10502577 | 12298 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 426 | 7 | 1 | 7 | 3.9 | COc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9700068 | ||
| CHEMBL1185771 | 12298 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 426 | 7 | 1 | 7 | 3.9 | COc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9700068 | ||
| CHEMBL432109 | 12298 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 426 | 7 | 1 | 7 | 3.9 | COc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9700068 | ||
| 10814776 | 99014 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 485 | 5 | 2 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9608366 | ||
| 10814776 | 99014 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 485 | 5 | 2 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL283136 | 99014 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 485 | 5 | 2 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9608366 | ||
| CHEMBL283136 | 99014 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 485 | 5 | 2 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 18184234 | 61880 | 0 | None | - | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL177802 | 61880 | 0 | None | - | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 9961131 | 131635 | 0 | None | - | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 650 | 15 | 2 | 12 | 3.1 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL369676 | 131635 | 0 | None | - | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 650 | 15 | 2 | 12 | 3.1 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 42630654 | 18220 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 10 | 2 | 8 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271531 | 18220 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 10 | 2 | 8 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10210086 | 60952 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 571 | 10 | 2 | 12 | 3.0 | C#CCOc1nc(-c2ccnc(-c3nn[nH]n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176664 | 60952 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 571 | 10 | 2 | 12 | 3.0 | C#CCOc1nc(-c2ccnc(-c3nn[nH]n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 42630654 | 18220 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 10 | 2 | 8 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1271531 | 18220 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 10 | 2 | 8 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 11071347 | 117303 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 516 | 11 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(F)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL340190 | 117303 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 516 | 11 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(F)c(F)c1 | 10.1021/jm010237l | ||
| 44279677 | 101756 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 478 | 2 | 2 | 3 | 4.0 | O=C1c2cc(Br)ccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(Br)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL30297 | 101756 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 478 | 2 | 2 | 3 | 4.0 | O=C1c2cc(Br)ccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(Br)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 10504475 | 205224 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.4 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)CC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9119 | 205224 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.4 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)CC(C)C)cc1 | 10.1021/jm9505369 | ||
| 44458669 | 84250 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 505 | 6 | 2 | 7 | 3.0 | Cc1ccccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL22249 | 84250 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 505 | 6 | 2 | 7 | 3.0 | Cc1ccccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| 10168939 | 130846 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 695 | 11 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368860 | 130846 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 695 | 11 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 76320429 | 85414 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 324 | 4 | 1 | 6 | 3.6 | Cc1c(C(=O)O)oc2cccc(OCc3ccc4nonc4c3)c12 | 10.1007/s00044-013-0542-3 | ||
| CHEMBL2296900 | 85414 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 324 | 4 | 1 | 6 | 3.6 | Cc1c(C(=O)O)oc2cccc(OCc3ccc4nonc4c3)c12 | 10.1007/s00044-013-0542-3 | ||
| 10625633 | 205410 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 514 | 12 | 1 | 8 | 2.4 | COCCN(CCOC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9223 | 205410 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 514 | 12 | 1 | 8 | 2.4 | COCCN(CCOC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10817024 | 12022 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NCC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184112 | 12022 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NCC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL332808 | 12022 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NCC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 11798504 | 96675 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 3.5 | CCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL267695 | 96675 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 3.5 | CCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 71458721 | 81289 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 642 | 14 | 2 | 10 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(C2CC2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163726 | 81289 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 642 | 14 | 2 | 10 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(C2CC2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2304010 | 207721 | 0 | None | - | 0 | Pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CSC(C)(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Cl)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 44320192 | 106573 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 480 | 6 | 1 | 5 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1Cc1cccc(Cl)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315622 | 106573 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 480 | 6 | 1 | 5 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1Cc1cccc(Cl)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 10321290 | 4568 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 445 | 7 | 1 | 5 | 5.1 | CCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102969 | 4568 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 445 | 7 | 1 | 5 | 5.1 | CCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44284287 | 160700 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 10 | 3 | 7 | 5.2 | CCC(CO)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL411925 | 160700 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 532 | 10 | 3 | 7 | 5.2 | CCC(CO)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| 44314657 | 102728 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 619 | 13 | 5 | 4 | 4.3 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL308383 | 102728 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 619 | 13 | 5 | 4 | 4.3 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| 159594 | 518 | 38 | None | - | 3 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1016/s0960-894x(98)00301-1 | ||
| 3487 | 518 | 38 | None | - | 3 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL9194 | 518 | 38 | None | - | 3 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1016/s0960-894x(98)00301-1 | ||
| DB06199 | 518 | 38 | None | - | 3 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1016/s0960-894x(98)00301-1 | ||
| 122044 | 10078 | 47 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 473 | 9 | 2 | 8 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCO)c1 | 10.1021/jm0102304 | ||
| CHEMBL115951 | 10078 | 47 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 473 | 9 | 2 | 8 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCO)c1 | 10.1021/jm0102304 | ||
| 15289330 | 99341 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 493 | 8 | 1 | 8 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL285368 | 99341 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 493 | 8 | 1 | 8 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 18995998 | 161841 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 9 | 1 | 9 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL416570 | 161841 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 9 | 1 | 9 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL438768 | 212048 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||||
| 15453179 | 203770 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80538 | 203770 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 11783885 | 100420 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.6 | CCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL293702 | 100420 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.6 | CCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| 44279350 | 167613 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1cccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)c1 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL433229 | 167613 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1cccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)c1 | 10.1016/0960-894X(95)00230-Q | ||
| 44314609 | 203040 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 720 | 12 | 6 | 4 | 5.6 | CC(C)CC(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)N[C@H](Cc1c(Br)[nH]c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL74471 | 203040 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 720 | 12 | 6 | 4 | 5.6 | CC(C)CC(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)N[C@H](Cc1c(Br)[nH]c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm9600914 | ||
| 44458999 | 167665 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 525 | 6 | 2 | 7 | 3.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(Cl)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL433619 | 167665 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 525 | 6 | 2 | 7 | 3.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(Cl)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 44266552 | 4446 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10218 | 4446 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 44317109 | 104413 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 472 | 3 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2cc(Br)ccc2Br)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311216 | 104413 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 472 | 3 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2cc(Br)ccc2Br)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10694591 | 9136 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 444 | 6 | 1 | 6 | 4.6 | CC(C)Oc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL11064 | 9136 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 444 | 6 | 1 | 6 | 4.6 | CC(C)Oc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 10551532 | 110095 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 450 | 8 | 1 | 4 | 3.9 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL325444 | 110095 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 450 | 8 | 1 | 4 | 3.9 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10791702 | 194143 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cccc3occc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL558148 | 194143 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cccc3occc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 15340612 | 106349 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144599 | 106349 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL2367550 | 207839 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||||
| 44439103 | 91519 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 859 | 27 | 2 | 14 | 5.3 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL241460 | 91519 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 859 | 27 | 2 | 14 | 5.3 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| 10836835 | 96654 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 7 | 2 | 5 | 3.8 | CCCCNC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL267483 | 96654 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 7 | 2 | 5 | 3.8 | CCCCNC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44351961 | 18648 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 522 | 13 | 1 | 5 | 5.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CCC)cc1 | 10.1021/jm010237l | ||
| CHEMBL128061 | 18648 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 522 | 13 | 1 | 5 | 5.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CCC)cc1 | 10.1021/jm010237l | ||
| 10218058 | 81257 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 12 | 2 | 10 | 3.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2163695 | 81257 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 12 | 2 | 10 | 3.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| 42630532 | 18215 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 541 | 10 | 2 | 7 | 4.9 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271479 | 18215 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 541 | 10 | 2 | 7 | 4.9 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10218058 | 81257 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 12 | 2 | 10 | 3.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCO | 10.1021/jm3009103 | ||
| CHEMBL2163695 | 81257 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 523 | 12 | 2 | 10 | 3.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCO | 10.1021/jm3009103 | ||
| 42630532 | 18215 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 541 | 10 | 2 | 7 | 4.9 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1271479 | 18215 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 541 | 10 | 2 | 7 | 4.9 | C=CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 22467230 | 84931 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 536 | 8 | 1 | 8 | 4.0 | COCc1ccc2c(C(C(=O)NS(=O)(=O)c3ccc(C)cc3OC)c3ccc4c(c3)OCO4)cn(C)c2c1 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261601 | 84931 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 536 | 8 | 1 | 8 | 4.0 | COCc1ccc2c(C(C(=O)NS(=O)(=O)c3ccc(C)cc3OC)c3ccc4c(c3)OCO4)cn(C)c2c1 | 10.1007/s00044-004-0021-y | ||
| 10281943 | 59749 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 589 | 10 | 1 | 10 | 4.9 | COCC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173743 | 59749 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 589 | 10 | 1 | 10 | 4.9 | COCC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 71460536 | 81274 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 589 | 11 | 1 | 12 | 3.1 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163712 | 81274 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 589 | 11 | 1 | 12 | 3.1 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 23445593 | 59919 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 4.7 | Cc1ccc(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL174086 | 59919 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 4.7 | Cc1ccc(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| 10553017 | 97656 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 488 | 7 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)c2ccccc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL273476 | 97656 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 488 | 7 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)c2ccccc2)cc1 | 10.1021/jm9505369 | ||
| 9807456 | 60150 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 545 | 9 | 1 | 9 | 4.8 | C#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175435 | 60150 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 545 | 9 | 1 | 9 | 4.8 | C#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 9852318 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL112624 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL1627022 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL263294 | 208819 | 0 | None | - | 0 | Bovine | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| CHEMBL385492 | 210605 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 1009 | 192 | 20 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| 5310991 | 192 | 20 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| CHEMBL332794 | 192 | 20 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| 9852318 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| CHEMBL112624 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| CHEMBL1627022 | 9523 | 5 | None | -2691 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| 21462932 | 48870 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 548 | 8 | 2 | 8 | 4.6 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(NS(C)(=O)=O)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL156194 | 48870 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 548 | 8 | 2 | 8 | 4.6 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(NS(C)(=O)=O)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 10173807 | 50609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL157742 | 50609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL410321 | 211065 | 0 | None | - | 0 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 9825494 | 200923 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL61211 | 200923 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL2304007 | 207718 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | Cc1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC1=O | 10.1021/jm9600914 | ||||
| 155551580 | 173421 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 526 | 12 | 2 | 10 | 3.0 | CCNS(=O)(=O)Nc1ncnc(OCCOc2cc(OC)ccc2Cl)c1-c1ncc(SC)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4542394 | 173421 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 526 | 12 | 2 | 10 | 3.0 | CCNS(=O)(=O)Nc1ncnc(OCCOc2cc(OC)ccc2Cl)c1-c1ncc(SC)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 11757759 | 173874 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 570 | 13 | 2 | 10 | 2.8 | COCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4553625 | 173874 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 570 | 13 | 2 | 10 | 2.8 | COCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 44311135 | 202489 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70800 | 202489 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 8260 | 527 | 46 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9912992 | 527 | 46 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL3989834 | 527 | 46 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 15453180 | 104746 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 348 | 4 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311510 | 104746 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 348 | 4 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| 10288020 | 14460 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 430 | 7 | 1 | 6 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205067 | 14460 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 430 | 7 | 1 | 6 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL48881 | 14460 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 430 | 7 | 1 | 6 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44266646 | 98113 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 475 | 6 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL276638 | 98113 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 475 | 6 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/s0960-894x(97)10151-2 | ||
| 10310877 | 202191 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 473 | 8 | 1 | 7 | 5.9 | CCCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)n2Cc1ccc2nsnc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL68896 | 202191 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 473 | 8 | 1 | 7 | 5.9 | CCCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)n2Cc1ccc2nsnc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| 10769526 | 102227 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 578 | 12 | 2 | 10 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL304762 | 102227 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 578 | 12 | 2 | 10 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| 44211959 | 55148 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 620 | 12 | 1 | 9 | 5.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(C)(=O)=O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL16197 | 55148 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 620 | 12 | 1 | 9 | 5.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(C)(=O)=O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 44327412 | 205847 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 497 | 5 | 1 | 8 | 3.0 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94929 | 205847 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 497 | 5 | 1 | 8 | 3.0 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 11038320 | 18685 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 492 | 11 | 1 | 4 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)cc1 | 10.1021/jm010237l | ||
| CHEMBL128240 | 18685 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 492 | 11 | 1 | 4 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)cc1 | 10.1021/jm010237l | ||
| 10501279 | 97766 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 402 | 6 | 1 | 5 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cccc(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL274307 | 97766 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 402 | 6 | 1 | 5 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cccc(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 44277368 | 106362 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 480 | 8 | 2 | 7 | 3.0 | COc1ccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144733 | 106362 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 480 | 8 | 2 | 7 | 3.0 | COc1ccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 44386144 | 61655 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 555 | 9 | 3 | 7 | 5.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)n2ccc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL177431 | 61655 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 555 | 9 | 3 | 7 | 5.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)n2ccc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44266575 | 4575 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 459 | 6 | 1 | 7 | 5.2 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10302 | 4575 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 459 | 6 | 1 | 7 | 5.2 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 9830773 | 129704 | 0 | None | - | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 636 | 14 | 2 | 12 | 2.8 | CCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367958 | 129704 | 0 | None | - | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 636 | 14 | 2 | 12 | 2.8 | CCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 44291897 | 100823 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 482 | 7 | 2 | 9 | 3.6 | COc1cc(C#N)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(OC)c1 | 10.1021/jm9608366 | ||
| CHEMBL296456 | 100823 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 482 | 7 | 2 | 9 | 3.6 | COc1cc(C#N)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(OC)c1 | 10.1021/jm9608366 | ||
| 9956918 | 170316 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 482 | 7 | 2 | 9 | 3.6 | COc1cc(C#N)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1OC | 10.1021/jm9700068 | ||
| CHEMBL44544 | 170316 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 482 | 7 | 2 | 9 | 3.6 | COc1cc(C#N)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1OC | 10.1021/jm9700068 | ||
| 10190108 | 130176 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 681 | 12 | 2 | 12 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368386 | 130176 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 681 | 12 | 2 | 12 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 19432672 | 202520 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 606 | 11 | 3 | 9 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCNC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70924 | 202520 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 606 | 11 | 3 | 9 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCNC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 23445333 | 127284 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 484 | 6 | 1 | 7 | 4.4 | Cc1cc2c(cc1CCc1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL366378 | 127284 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 484 | 6 | 1 | 7 | 4.4 | Cc1cc2c(cc1CCc1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| 10599829 | 96681 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 454 | 9 | 2 | 6 | 3.2 | CCCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL267761 | 96681 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 454 | 9 | 2 | 6 | 3.2 | CCCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44368390 | 45051 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 475 | 9 | 2 | 6 | 3.9 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2ccc(O)cc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152654 | 45051 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 475 | 9 | 2 | 6 | 3.9 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2ccc(O)cc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 71462321 | 81595 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 584 | 12 | 2 | 8 | 4.2 | CCc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165335 | 81595 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 584 | 12 | 2 | 8 | 4.2 | CCc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| 10577111 | 205170 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 4.0 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)COc2ccc(F)cc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9084 | 205170 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 4.0 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)COc2ccc(F)cc2)cc1 | 10.1021/jm9505369 | ||
| 44371495 | 53960 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 10 | 1 | 8 | 5.4 | CCCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL160768 | 53960 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 10 | 1 | 8 | 5.4 | CCCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| 44314575 | 103097 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 13 | 5 | 5 | 4.2 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL308584 | 103097 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 13 | 5 | 5 | 4.2 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44314723 | 203289 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 583 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL76735 | 203289 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 583 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44386169 | 130867 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 690 | 12 | 2 | 14 | 3.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368996 | 130867 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 690 | 12 | 2 | 14 | 3.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 123883 | 14475 | 1 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 927 | 12 | 9 | 11 | 0.8 | CC(C)C[C@@H]1NC(=O)[C@@H](c2cccs2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)N2CCN(c3ccccc3)CC2)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm970101g | ||
| CHEMBL1205177 | 14475 | 1 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 927 | 12 | 9 | 11 | 0.8 | CC(C)C[C@@H]1NC(=O)[C@@H](c2cccs2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)N2CCN(c3ccccc3)CC2)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm970101g | ||
| CHEMBL61425 | 14475 | 1 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 927 | 12 | 9 | 11 | 0.8 | CC(C)C[C@@H]1NC(=O)[C@@H](c2cccs2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)N2CCN(c3ccccc3)CC2)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm970101g | ||
| 11102201 | 201532 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 9 | 1 | 6 | 5.1 | C=CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL64447 | 201532 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 9 | 1 | 6 | 5.1 | C=CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 11005243 | 201690 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL65337 | 201690 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL2304015 | 207726 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | Cc1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@@H](C2CC2)NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC1=O | 10.1021/jm9600914 | ||||
| 10505755 | 14415 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 506 | 10 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10832 | 14415 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 506 | 10 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL1204670 | 14415 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 506 | 10 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 44334053 | 4483 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 465 | 5 | 1 | 5 | 5.5 | COc1ccc([C@@H]2c3nc(-c4ccccc4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102411 | 4483 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 465 | 5 | 1 | 5 | 5.5 | COc1ccc([C@@H]2c3nc(-c4ccccc4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL328942 | 209570 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||||
| 44371516 | 50712 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 7 | 1 | 6 | 5.6 | CCOc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc(OC)cc2)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL157827 | 50712 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 469 | 7 | 1 | 6 | 5.6 | CCOc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc(OC)cc2)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| 44351968 | 117577 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| CHEMBL340575 | 117577 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| 44327348 | 161358 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 1076 | 28 | 9 | 8 | 7.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL415238 | 161358 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 1076 | 28 | 9 | 8 | 7.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL407933 | 210947 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | 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](NC(=O)NC1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10503067 | 8086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 436 | 5 | 1 | 6 | 4.9 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCCCC2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10919 | 8086 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 436 | 5 | 1 | 6 | 4.9 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCCCC2)cc1 | 10.1021/jm9606507 | ||
| 15411005 | 4692 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 677 | 13 | 1 | 12 | 5.2 | CCOC(=O)C(NC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1)C(C)C | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL103846 | 4692 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 677 | 13 | 1 | 12 | 5.2 | CCOC(=O)C(NC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1)C(C)C | 10.1016/S0960-894X(97)00002-4 | ||
| 11026025 | 201196 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 412 | 7 | 1 | 6 | 4.6 | CCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL62669 | 201196 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 412 | 7 | 1 | 6 | 4.6 | CCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 11762081 | 201628 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 5.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc(OC)cc3)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64851 | 201628 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 5.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc(OC)cc3)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL147908 | 207039 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 10649086 | 174681 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 500 | 5 | 3 | 8 | 4.0 | Cc1noc(NS(=O)(=O)c2ccsc2NC(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL45723 | 174681 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 500 | 5 | 3 | 8 | 4.0 | Cc1noc(NS(=O)(=O)c2ccsc2NC(=O)Nc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 44299023 | 194823 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.7 | CCc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL56343 | 194823 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 457 | 6 | 1 | 6 | 4.7 | CCc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| 56681797 | 62994 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 937 | 26 | 9 | 9 | 3.6 | CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@H](C)CC | 10.1021/jm970161m | ||
| CHEMBL1793924 | 62994 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 937 | 26 | 9 | 9 | 3.6 | CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@H](C)CC | 10.1021/jm970161m | ||
| 44270523 | 48352 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 724 | 14 | 1 | 9 | 8.0 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL15573 | 48352 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 724 | 14 | 1 | 9 | 8.0 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 15453178 | 104274 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 348 | 4 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL310739 | 104274 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 348 | 4 | 1 | 4 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| 18617303 | 105315 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1cccc(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL312685 | 105315 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1cccc(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 18617389 | 162926 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 408 | 3 | 1 | 4 | 3.6 | Cc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL420029 | 162926 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 408 | 3 | 1 | 4 | 3.6 | Cc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 18617374 | 203805 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80808 | 203805 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL414917 | 211412 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | None | None | None | NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)C1c2ccccc2CCc2ccccc21)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| 10575552 | 110821 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 450 | 8 | 1 | 5 | 4.2 | CCCN(C)C(=O)CN1C[C@H](c2ccc3ccoc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL326690 | 110821 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 450 | 8 | 1 | 5 | 4.2 | CCCN(C)C(=O)CN1C[C@H](c2ccc3ccoc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL2369710 | 207908 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 9915028 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm010237l | ||
| CHEMBL111612 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm010237l | ||
| CHEMBL4761843 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm010237l | ||
| 44385621 | 127674 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2C)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL366544 | 127674 | 0 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2C)nc1C(=O)O | 10.1021/jm950592+ | ||
| 23445537 | 60817 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 514 | 8 | 1 | 8 | 4.9 | CCCc1cc2c(cc1OCc1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL176538 | 60817 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 514 | 8 | 1 | 8 | 4.9 | CCCc1cc2c(cc1OCc1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00132-7 | ||
| 44320488 | 106502 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.7 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1C1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315175 | 106502 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.7 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1C1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 23445547 | 111850 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2cc(-c3ccccc3)cs2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL329375 | 111850 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2cc(-c3ccccc3)cs2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 137652304 | 156684 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 10 | 3 | 8 | 3.7 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCCN)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4076290 | 156684 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 10 | 3 | 8 | 3.7 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCCN)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10119105 | 100977 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 526 | 7 | 2 | 9 | 3.1 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CC(=O)N(C)C)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL297618 | 100977 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 526 | 7 | 2 | 9 | 3.1 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CC(=O)N(C)C)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 11798504 | 96675 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 3.5 | CCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL267695 | 96675 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 3.5 | CCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 23445336 | 59860 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.3 | Cc1cc(C)c(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL173977 | 59860 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.3 | Cc1cc(C)c(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44314890 | 104597 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 647 | 12 | 5 | 4 | 5.0 | CC(C)CC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL311384 | 104597 | 0 | None | - | 0 | Pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 647 | 12 | 5 | 4 | 5.0 | CC(C)CC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44334128 | 4340 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.9 | C=CCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL101424 | 4340 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 443 | 7 | 1 | 5 | 4.9 | C=CCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44334145 | 4584 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 4.6 | COc1ccc([C@@H]2c3nc(N(C)C(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL103090 | 4584 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 4.6 | COc1ccc([C@@H]2c3nc(N(C)C(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44284292 | 167549 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 518 | 8 | 3 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)(C)O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL432856 | 167549 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 518 | 8 | 3 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)(C)O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 44311346 | 102688 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 681 | 13 | 2 | 13 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCSCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL308088 | 102688 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 681 | 13 | 2 | 13 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCSCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 17885912 | 106615 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 496 | 7 | 2 | 6 | 5.1 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCCC(C(=O)O)C1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315936 | 106615 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 496 | 7 | 2 | 6 | 5.1 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCCC(C(=O)O)C1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL433406 | 211892 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | 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](NC(=O)NC)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 15453172 | 203277 | 4 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76623 | 203277 | 4 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44298381 | 194230 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 476 | 9 | 2 | 7 | 4.9 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL55909 | 194230 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 476 | 9 | 2 | 7 | 4.9 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL2304009 | 207720 | 0 | None | - | 0 | Pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| CHEMBL86814 | 214115 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | 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](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 44333721 | 167230 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 447 | 7 | 1 | 6 | 4.3 | CCOCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL430506 | 167230 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 447 | 7 | 1 | 6 | 4.3 | CCOCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL436899 | 211946 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||||
| 10916428 | 162145 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL417050 | 162145 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| 44295106 | 14573 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 472 | 7 | 1 | 7 | 4.6 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)CCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206319 | 14573 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 472 | 7 | 1 | 7 | 4.6 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)CCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL262000 | 14573 | 0 | None | - | 0 | Pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 472 | 7 | 1 | 7 | 4.6 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)CCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 10212163 | 129574 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 696 | 11 | 2 | 13 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367767 | 129574 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 696 | 11 | 2 | 13 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 44266646 | 98113 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 475 | 6 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL276638 | 98113 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 475 | 6 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| 122272 | 96650 | 23 | None | - | 2 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 345 | 4 | 1 | 5 | 3.3 | Cc1noc(NS(=O)(=O)c2cccc3c(N(C)C)cccc23)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL267458 | 96650 | 23 | None | - | 2 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 345 | 4 | 1 | 5 | 3.3 | Cc1noc(NS(=O)(=O)c2cccc3c(N(C)C)cccc23)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 18617345 | 104725 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311461 | 104725 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 18617314 | 203521 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 334 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccc(F)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78734 | 203521 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 334 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccc(F)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 3811690 | 203699 | 3 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1noc(NS(=O)(=O)c2ccc(Br)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80129 | 203699 | 3 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1noc(NS(=O)(=O)c2ccc(Br)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL441006 | 212127 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | None | None | None | CC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| 44277035 | 106369 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 4.2 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1cccc(Cl)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144806 | 106369 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 4.2 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1cccc(Cl)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10646831 | 183338 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 441 | 6 | 2 | 7 | 4.1 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9608366 | ||
| 10646831 | 183338 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 441 | 6 | 2 | 7 | 4.1 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL48134 | 183338 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 441 | 6 | 2 | 7 | 4.1 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9608366 | ||
| CHEMBL48134 | 183338 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 441 | 6 | 2 | 7 | 4.1 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL1791277 | 207175 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)[C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 10625530 | 205311 | 3 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9162 | 205311 | 3 | None | - | 0 | Pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44266595 | 4327 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 6.0 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc(OCc3ccccc3)ccc2n1-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10136 | 4327 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 507 | 6 | 1 | 7 | 6.0 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc(OCc3ccccc3)ccc2n1-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 10766385 | 97976 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 460 | 6 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm9606507 | ||
| CHEMBL275559 | 97976 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 460 | 6 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm9606507 | ||
| 9870959 | 8829 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| CHEMBL109778 | 8829 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| 10811595 | 98312 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 4.1 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9608366 | ||
| 10811595 | 98312 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 4.1 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9700068 | ||
| CHEMBL278114 | 98312 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 4.1 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9608366 | ||
| CHEMBL278114 | 98312 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 4.1 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)cc1 | 10.1021/jm9700068 | ||
| 155562688 | 174608 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 554 | 13 | 2 | 10 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4570529 | 174608 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 554 | 13 | 2 | 10 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 44352026 | 116982 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C(F)(F)F)cc1 | 10.1021/jm010237l | ||
| CHEMBL339969 | 116982 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 548 | 11 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C(F)(F)F)cc1 | 10.1021/jm010237l | ||
| 137633653 | 156056 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 593 | 10 | 2 | 9 | 5.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4068786 | 156056 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 593 | 10 | 2 | 9 | 5.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 44311283 | 101863 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 649 | 11 | 2 | 10 | 6.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(C)(C)C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL303649 | 101863 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 649 | 11 | 2 | 10 | 6.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(C)(C)C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10553490 | 180534 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 8 | 3 | 10 | 2.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2OCCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL47604 | 180534 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 8 | 3 | 10 | 2.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2OCCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 71455062 | 81267 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 669 | 14 | 1 | 12 | 5.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C(F)(F)F)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163705 | 81267 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 669 | 14 | 1 | 12 | 5.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C(F)(F)F)cn1 | 10.1021/jm3009103 | ||
| 44266538 | 5391 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 4 | 1 | 4 | 4.8 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccccc1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10750 | 5391 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 371 | 4 | 1 | 4 | 4.8 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccccc1 | 10.1016/0960-894X(96)00170-9 | ||
| 52950137 | 18250 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 559 | 10 | 3 | 8 | 3.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(=O)O)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271863 | 18250 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 559 | 10 | 3 | 8 | 3.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(=O)O)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 71456863 | 81278 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2163716 | 81278 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 71456863 | 81278 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163716 | 81278 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 10625083 | 204920 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 496 | 10 | 1 | 5 | 5.3 | CCCCN(CCCC)C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8925 | 204920 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 496 | 10 | 1 | 5 | 5.3 | CCCCN(CCCC)C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 71460537 | 81285 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 660 | 12 | 1 | 13 | 2.7 | COc1ccccc1Oc1c(NS(=O)(=O)N2CCOCC2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163722 | 81285 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 660 | 12 | 1 | 13 | 2.7 | COc1ccccc1Oc1c(NS(=O)(=O)N2CCOCC2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 21041266 | 81600 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 584 | 10 | 2 | 8 | 3.3 | O=S(=O)(Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1)NC1CC1 | 10.1021/jm3009103 | ||
| CHEMBL2165340 | 81600 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 584 | 10 | 2 | 8 | 3.3 | O=S(=O)(Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1)NC1CC1 | 10.1021/jm3009103 | ||
| 44304492 | 96112 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL262993 | 96112 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL2304006 | 207717 | 0 | None | - | 0 | Pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | O=C(O)C[C@H]1NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC(=O)[C@@H](C2CC2)NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm9600914 | ||||
| 22467235 | 96078 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 533 | 7 | 2 | 7 | 3.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1007/s00044-004-0021-y | ||
| CHEMBL262784 | 96078 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 533 | 7 | 2 | 7 | 3.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1007/s00044-004-0021-y | ||
| 23288645 | 169160 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 580 | 12 | 3 | 8 | 5.6 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(SC)cc3)cc(C(=O)Nc3ccccc3)cc2OCCO)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4438411 | 169160 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 580 | 12 | 3 | 8 | 5.6 | COc1cccc(Oc2c(NS(=O)(=O)c3ccc(SC)cc3)cc(C(=O)Nc3ccccc3)cc2OCCO)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9917072 | 61774 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 619 | 16 | 2 | 10 | 4.6 | CCCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL177538 | 61774 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 619 | 16 | 2 | 10 | 4.6 | CCCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 44304492 | 96112 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||
| CHEMBL262993 | 96112 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||
| 44284287 | 160700 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 532 | 10 | 3 | 7 | 5.2 | CCC(CO)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL411925 | 160700 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 532 | 10 | 3 | 7 | 5.2 | CCC(CO)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL94983 | 214139 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10983045 | 201217 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 440 | 9 | 1 | 6 | 5.3 | CCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL62762 | 201217 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 440 | 9 | 1 | 6 | 5.3 | CCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 11144344 | 201323 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 424 | 8 | 1 | 5 | 5.8 | CCCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL63267 | 201323 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 424 | 8 | 1 | 5 | 5.8 | CCCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL89736 | 214124 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | 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](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL328942 | 209570 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00095a029 | ||||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10671649 | 98114 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 5 | 1 | 8 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL276639 | 98114 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 5 | 1 | 8 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 10961546 | 96311 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL264543 | 96311 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 18738881 | 79173 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 534 | 7 | 2 | 7 | 4.4 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(=O)O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL2114305 | 79173 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 534 | 7 | 2 | 7 | 4.4 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(=O)O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 19363918 | 14467 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 474 | 7 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)OCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205106 | 14467 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 474 | 7 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)OCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL52535 | 14467 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 474 | 7 | 1 | 8 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc3c(c2)OCO3)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1793934 | 207189 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm970161m | ||||
| 18995988 | 99873 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 389 | 6 | 1 | 4 | 5.5 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccccc3)c3ccccc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28948 | 99873 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 389 | 6 | 1 | 4 | 5.5 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccccc3)c3ccccc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 44317215 | 203552 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 266 | 3 | 1 | 4 | 2.4 | Cc1ccc(S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78952 | 203552 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 266 | 3 | 1 | 4 | 2.4 | Cc1ccc(S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1016/0960-894X(96)00441-6 | ||
| 18617377 | 203763 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 344 | 3 | 1 | 4 | 3.2 | Cc1ccc(C)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80484 | 203763 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 344 | 3 | 1 | 4 | 3.2 | Cc1ccc(C)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 10665805 | 97726 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 354 | 4 | 1 | 6 | 3.0 | CCC1=C(c2ccc3c(c2)OCO3)C(=O)OC1(O)c1ccc(OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL273951 | 97726 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 354 | 4 | 1 | 6 | 3.0 | CCC1=C(c2ccc3c(c2)OCO3)C(=O)OC1(O)c1ccc(OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL413880 | 211346 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| 10882352 | 201294 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 340 | 4 | 1 | 5 | 3.4 | CCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL63099 | 201294 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 340 | 4 | 1 | 5 | 3.4 | CCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| 44276577 | 106374 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 459 | 7 | 1 | 7 | 4.1 | COc1cccc(Cn2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144850 | 106374 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 459 | 7 | 1 | 7 | 4.1 | COc1cccc(Cn2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 44266592 | 5303 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 431 | 4 | 1 | 7 | 4.5 | COc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10699 | 5303 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 431 | 4 | 1 | 7 | 4.5 | COc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 71458718 | 81262 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 615 | 14 | 1 | 12 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163700 | 81262 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 615 | 14 | 1 | 12 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C)cn1 | 10.1021/jm3009103 | ||
| 23445250 | 167543 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.8 | Cc1cc(CC(C)C)ccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL432815 | 167543 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.8 | Cc1cc(CC(C)C)ccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 10302118 | 60103 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 533 | 9 | 2 | 10 | 3.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175111 | 60103 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 533 | 9 | 2 | 10 | 3.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 18184249 | 127950 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 662 | 13 | 2 | 11 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL366628 | 127950 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 662 | 13 | 2 | 11 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10528383 | 11131 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 470 | 5 | 1 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)c2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL1178854 | 11131 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 470 | 5 | 1 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)c2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL46357 | 11131 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 470 | 5 | 1 | 8 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)c2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 9915028 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL111612 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL4761843 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| 9955200 | 9242 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL11115 | 9242 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| 24997097 | 18287 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 7 | 3 | 7 | 4.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1272137 | 18287 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 7 | 3 | 7 | 4.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 23445507 | 59448 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 4.5 | Cc1ccc(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL172538 | 59448 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 4.5 | Cc1ccc(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00132-7 | ||
| 24997097 | 18287 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 7 | 3 | 7 | 4.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1272137 | 18287 | 2 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 501 | 7 | 3 | 7 | 4.0 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 11797486 | 11938 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 442 | 6 | 2 | 8 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(O)Cc2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL1183448 | 11938 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 442 | 6 | 2 | 8 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(O)Cc2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL297557 | 11938 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 442 | 6 | 2 | 8 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(O)Cc2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| 10671037 | 130922 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 446 | 8 | 1 | 6 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL273660 | 130922 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 446 | 8 | 1 | 6 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL369085 | 130922 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 446 | 8 | 1 | 6 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 21041264 | 81599 | 1 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 600 | 12 | 2 | 8 | 4.0 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165339 | 81599 | 1 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 600 | 12 | 2 | 8 | 4.0 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 10554539 | 100773 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 543 | 9 | 2 | 11 | 3.4 | CC(=O)OCCOc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| CHEMBL296129 | 100773 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 543 | 9 | 2 | 11 | 3.4 | CC(=O)OCCOc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| 10743872 | 96759 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 496 | 13 | 1 | 6 | 5.2 | CCCCN(CCCC)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL268432 | 96759 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 496 | 13 | 1 | 6 | 5.2 | CCCCN(CCCC)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL319719 | 209475 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10625270 | 112876 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C)cccc2C)cc1 | 10.1021/jm990170q | ||
| CHEMBL331767 | 112876 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C)cccc2C)cc1 | 10.1021/jm990170q | ||
| 177236 | 1298 | 39 | None | -134 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 3508 | 1298 | 39 | None | -134 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL23261 | 1298 | 39 | None | -134 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00660-6 | ||
| DB04883 | 1298 | 39 | None | -134 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 9853077 | 59315 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 696 | 13 | 2 | 12 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172030 | 59315 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 696 | 13 | 2 | 12 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10950843 | 201263 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1cccc(OC)c1)O2 | 10.1021/jm010382z | ||
| CHEMBL62951 | 201263 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1cccc(OC)c1)O2 | 10.1021/jm010382z | ||
| 10152810 | 14617 | 1 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.8 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1F | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206706 | 14617 | 1 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.8 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1F | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL298725 | 14617 | 1 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.8 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1F | 10.1016/s0960-894x(98)00301-1 | ||
| 44311284 | 202543 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 635 | 12 | 2 | 10 | 6.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(C)C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL71070 | 202543 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 635 | 12 | 2 | 10 | 6.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(C)C)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 44371532 | 51200 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cccc(OC)c3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL158239 | 51200 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cccc(OC)c3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 44278161 | 99343 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 6.9 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OCc4ccccc4)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL285380 | 99343 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 6.9 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OCc4ccccc4)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL2370247 | 208068 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | 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](C(c2ccccc2)c2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]([C@@H](C)CC)NC1=O | 10.1021/jm00015a003 | ||||
| 10790686 | 5179 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 474 | 5 | 1 | 8 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc3c(c2)OCCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10635 | 5179 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 474 | 5 | 1 | 8 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc3c(c2)OCCO3)cc1 | 10.1021/jm9606507 | ||
| 10552007 | 6246 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 462 | 8 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c(OC)c(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10819 | 6246 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 462 | 8 | 1 | 7 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c(OC)c(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 11058717 | 201128 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 412 | 8 | 1 | 6 | 4.6 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCC)cc21 | 10.1021/jm010382z | ||
| CHEMBL62348 | 201128 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 412 | 8 | 1 | 6 | 4.6 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCC)cc21 | 10.1021/jm010382z | ||
| 10951244 | 201264 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1cc(OC)ccc1OC)O2 | 10.1021/jm010382z | ||
| CHEMBL62962 | 201264 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1cc(OC)ccc1OC)O2 | 10.1021/jm010382z | ||
| 44294580 | 14466 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 8 | 1 | 7 | 5.8 | COc1ccc(C(=O)/C(Cc2ccc(OC(C)(C)C)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205104 | 14466 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 8 | 1 | 7 | 5.8 | COc1ccc(C(=O)/C(Cc2ccc(OC(C)(C)C)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL52338 | 14466 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 8 | 1 | 7 | 5.8 | COc1ccc(C(=O)/C(Cc2ccc(OC(C)(C)C)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44266552 | 4446 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL10218 | 4446 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/s0960-894x(97)10151-2 | ||
| 44310016 | 202142 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 489 | 6 | 1 | 9 | 4.8 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4nsnc4c3)c2cc1OC | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL68557 | 202142 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 489 | 6 | 1 | 9 | 4.8 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4nsnc4c3)c2cc1OC | 10.1016/s0960-894x(97)10151-2 | ||
| 10195727 | 202229 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 487 | 7 | 1 | 8 | 5.6 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2nsnc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL69150 | 202229 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 487 | 7 | 1 | 8 | 5.6 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2nsnc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| 9809526 | 14690 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 614 | 12 | 2 | 11 | 3.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCS(=O)(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL1207463 | 14690 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 614 | 12 | 2 | 11 | 3.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCS(=O)(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL408055 | 14690 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 614 | 12 | 2 | 11 | 3.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCS(=O)(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| 19010508 | 56051 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 501 | 9 | 1 | 7 | 5.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL16306 | 56051 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 501 | 9 | 1 | 7 | 5.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 22616262 | 203828 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 366 | 3 | 1 | 4 | 3.7 | Cc1noc(NS(=O)(=O)c2cccc3ccccc23)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80980 | 203828 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 366 | 3 | 1 | 4 | 3.7 | Cc1noc(NS(=O)(=O)c2cccc3ccccc23)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10505209 | 9227 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 490 | 6 | 1 | 9 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL11106 | 9227 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 490 | 6 | 1 | 9 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 10767210 | 110827 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 484 | 12 | 1 | 4 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cccc(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL326719 | 110827 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 484 | 12 | 1 | 4 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cccc(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10813007 | 112821 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL331577 | 112821 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 137655525 | 158445 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 525 | 7 | 3 | 9 | 3.5 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4096346 | 158445 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 525 | 7 | 3 | 9 | 3.5 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(O)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 71462247 | 81286 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2cnccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163723 | 81286 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 14 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2cnccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 71455063 | 81283 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 646 | 15 | 2 | 12 | 3.8 | CCCCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163720 | 81283 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 646 | 15 | 2 | 12 | 3.8 | CCCCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 10304227 | 129486 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 603 | 10 | 2 | 13 | 4.2 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367686 | 129486 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 603 | 10 | 2 | 13 | 4.2 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 9915028 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL111612 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL4761843 | 9321 | 12 | None | -28183 | 2 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| 10744041 | 96853 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)Cc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL269108 | 96853 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)Cc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| 10140965 | 100703 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 485 | 7 | 3 | 9 | 3.0 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL295588 | 100703 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 485 | 7 | 3 | 9 | 3.0 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 44371357 | 119234 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 8 | 1 | 8 | 5.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2cc(OC)c(OC)c(OC)c2)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL347680 | 119234 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 8 | 1 | 8 | 5.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2cc(OC)c(OC)c(OC)c2)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| 18995992 | 99377 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28563 | 99377 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 10994373 | 161904 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 5 | 1 | 7 | 5.0 | CC(C)Oc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL416675 | 161904 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 5 | 1 | 7 | 5.0 | CC(C)Oc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 11102844 | 201550 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 4.2 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)CO)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64536 | 201550 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 4.2 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)CO)cc32)cc1 | 10.1021/jm010382z | ||
| 44314581 | 104398 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 591 | 11 | 6 | 5 | 2.8 | Cc1[nH]c2ccccc2c1C[C@@H](NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL311134 | 104398 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 591 | 11 | 6 | 5 | 2.8 | Cc1[nH]c2ccccc2c1C[C@@H](NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL2304014 | 207725 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(C#N)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 44311233 | 202409 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 12 | 2 | 13 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70303 | 202409 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 630 | 12 | 2 | 13 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL408141 | 210956 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||||
| CHEMBL436884 | 211942 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||||
| 44327726 | 206156 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 495 | 6 | 1 | 8 | 2.7 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)n2nc3c(cc2=O)CCC3)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL96644 | 206156 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 495 | 6 | 1 | 8 | 2.7 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)n2nc3c(cc2=O)CCC3)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 18617393 | 203566 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 308 | 5 | 1 | 4 | 3.2 | CCc1ccc(CC)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL79066 | 203566 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 308 | 5 | 1 | 4 | 3.2 | CCc1ccc(CC)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 10623877 | 8403 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 461 | 6 | 1 | 8 | 3.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc([N+](=O)[O-])cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10940 | 8403 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 461 | 6 | 1 | 8 | 3.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc([N+](=O)[O-])cc2)cc1 | 10.1021/jm9606507 | ||
| 10649122 | 9647 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 502 | 12 | 1 | 4 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(F)c(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL113400 | 9647 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 502 | 12 | 1 | 4 | 5.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(F)c(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 15340616 | 106351 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 420 | 4 | 1 | 6 | 3.3 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccc2c(c1)OCO2 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144602 | 106351 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 420 | 4 | 1 | 6 | 3.3 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccc2c(c1)OCO2 | 10.1016/s0960-894x(00)00232-8 | ||
| 10344511 | 59371 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 466 | 5 | 1 | 5 | 5.7 | Cc1cc(C)c(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL172248 | 59371 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 466 | 5 | 1 | 5 | 5.7 | Cc1cc(C)c(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 10525281 | 182268 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.2 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL47915 | 182268 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.2 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)c(C)c1 | 10.1021/jm9700068 | ||
| 12286 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 6433095 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL109648 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| DB06677 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 10342643 | 5088 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm9606507 | ||
| CHEMBL10588 | 5088 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 430 | 5 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1C | 10.1021/jm9606507 | ||
| 71455061 | 81261 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 511 | 11 | 1 | 12 | 2.4 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| CHEMBL2163699 | 81261 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 511 | 11 | 1 | 12 | 2.4 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| 5310990 | 166277 | 9 | None | - | 1 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL428504 | 166277 | 9 | None | - | 1 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10741025 | 181099 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1cc(C)cc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| CHEMBL47765 | 181099 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1cc(C)cc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| 44320782 | 106589 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 482 | 7 | 1 | 6 | 5.8 | COc1ccc(-c2nn(CC3CCCCC3)c(C(=O)O)c2Cc2cc3c(cc2Cl)OCO3)cc1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315788 | 106589 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 482 | 7 | 1 | 6 | 5.8 | COc1ccc(-c2nn(CC3CCCCC3)c(C(=O)O)c2Cc2cc3c(cc2Cl)OCO3)cc1 | 10.1016/s0960-894x(00)00513-8 | ||
| 23445438 | 61170 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 470 | 6 | 1 | 7 | 4.1 | Cc1noc(NS(=O)(=O)c2sccc2CCc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL177070 | 61170 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 470 | 6 | 1 | 7 | 4.1 | Cc1noc(NS(=O)(=O)c2sccc2CCc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 10815726 | 11343 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 516 | 8 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180348 | 11343 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 516 | 8 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL123146 | 11343 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 516 | 8 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| 10122442 | 130175 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 660 | 14 | 2 | 11 | 5.6 | CCCCNC(=O)OCC#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368383 | 130175 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 660 | 14 | 2 | 11 | 5.6 | CCCCNC(=O)OCC#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10602743 | 7078 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 550 | 9 | 1 | 10 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1C | 10.1021/jm9606507 | ||
| CHEMBL10854 | 7078 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 550 | 9 | 1 | 10 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1C | 10.1021/jm9606507 | ||
| 9933950 | 201138 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL62395 | 201138 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 44295173 | 14464 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 554 | 10 | 1 | 9 | 5.3 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1Cl | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205090 | 14464 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 554 | 10 | 1 | 9 | 5.3 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1Cl | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL51234 | 14464 | 0 | None | - | 0 | Pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 554 | 10 | 1 | 9 | 5.3 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1Cl | 10.1016/s0960-894x(98)00301-1 | ||
| 9868822 | 8505 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 459 | 6 | 1 | 7 | 3.9 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(N(C)C)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10948 | 8505 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 459 | 6 | 1 | 7 | 3.9 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(N(C)C)cc2)cc1 | 10.1021/jm9606507 | ||
| 9960931 | 107535 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 635 | 12 | 1 | 12 | 4.1 | CCOC(=O)CNC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL319452 | 107535 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 635 | 12 | 1 | 12 | 4.1 | CCOC(=O)CNC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL433349 | 211889 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 9868379 | 100316 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 5.6 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)s1 | 10.1021/jm010382z | ||
| CHEMBL293012 | 100316 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 5.6 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)s1 | 10.1021/jm010382z | ||
| 11733232 | 201176 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1cccc2c1C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL62586 | 201176 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1cccc2c1C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 11826062 | 201300 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 426 | 8 | 2 | 6 | 4.3 | CC(C)Oc1ccc2c(c1)C(CCCCO)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL63113 | 201300 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 426 | 8 | 2 | 6 | 4.3 | CC(C)Oc1ccc2c(c1)C(CCCCO)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 9868379 | 100316 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 5.6 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)s1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL293012 | 100316 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 450 | 5 | 1 | 6 | 5.6 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)s1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44295032 | 14621 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1cccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206717 | 14621 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1cccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL299572 | 14621 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1cccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)c1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44294929 | 14625 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C/C(C(=O)c2ccc(OC)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206731 | 14625 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C/C(C(=O)c2ccc(OC)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL301971 | 14625 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C/C(C(=O)c2ccc(OC)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL317064 | 209451 | 13 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | 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/jm00095a029 | ||||
| 11798999 | 205851 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 482 | 7 | 1 | 6 | 3.8 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)CC(C)(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9495 | 205851 | 0 | None | - | 0 | Pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 482 | 7 | 1 | 6 | 3.8 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)CC(C)(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL303185 | 209172 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00089a028 | ||||
| 10647021 | 6896 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1OC | 10.1021/jm9606507 | ||
| CHEMBL10846 | 6896 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1OC | 10.1021/jm9606507 | ||
| 10740614 | 97856 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1cccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)c1 | 10.1021/jm9606507 | ||
| CHEMBL274857 | 97856 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1cccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)c1 | 10.1021/jm9606507 | ||
| CHEMBL303185 | 209172 | 0 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm9600914 | ||||
| 443289 | 703 | 40 | None | - | 3 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00237-N | ||||
| 997 | 703 | 40 | None | - | 3 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00237-N | ||||
| CHEMBL314691 | 703 | 40 | None | - | 3 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00237-N | ||||
| DB12054 | 703 | 40 | None | - | 3 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00237-N | ||||
| CHEMBL336033 | 209828 | 1 | None | - | 0 | Pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 9806559 | 9061 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 515 | 13 | 1 | 6 | 3.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCC1=O | 10.1021/jm980217s | ||
| CHEMBL110053 | 9061 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 515 | 13 | 1 | 6 | 3.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCC1=O | 10.1021/jm980217s | ||
| 10224228 | 179032 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1ccc(C)c(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| CHEMBL47424 | 179032 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1ccc(C)c(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| 10601795 | 96524 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 510 | 10 | 1 | 6 | 4.4 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(CC(C)C)CC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266354 | 96524 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 510 | 10 | 1 | 6 | 4.4 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(CC(C)C)CC(C)C)cc1 | 10.1021/jm9505369 | ||
| 73669994 | 117127 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 9 | 1 | 7 | 4.7 | N#Cc1ccc(OCc2ccc3nonc3c2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL3400996 | 117127 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 9 | 1 | 7 | 4.7 | N#Cc1ccc(OCc2ccc3nonc3c2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| 10140871 | 58939 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 484 | 9 | 2 | 9 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)ncnc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL170342 | 58939 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 484 | 9 | 2 | 9 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)ncnc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 10224745 | 112193 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 432 | 5 | 2 | 6 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL330425 | 112193 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 432 | 5 | 2 | 6 | 2.4 | Cc1cc(C)nc(O[C@H](C(=O)O)[C@@]2(c3ccccc3)NCC(=O)N(C)c3ccccc32)n1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10647373 | 96523 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 454 | 8 | 2 | 6 | 3.0 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)NCC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266337 | 96523 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 454 | 8 | 2 | 6 | 3.0 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)NCC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL273391 | 209064 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | 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](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| CHEMBL273391 | 209064 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | 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](Cc1ccccc1)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/jm00070a001 | ||||
| 44284238 | 99665 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 490 | 8 | 3 | 7 | 4.2 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL287622 | 99665 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 490 | 8 | 3 | 7 | 4.2 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 9874557 | 129216 | 0 | None | - | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 667 | 15 | 2 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367443 | 129216 | 0 | None | - | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 667 | 15 | 2 | 10 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44311516 | 202418 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 678 | 12 | 2 | 12 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70339 | 202418 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 678 | 12 | 2 | 12 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 71453357 | 81270 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 707 | 12 | 1 | 12 | 5.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163708 | 81270 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 707 | 12 | 1 | 12 | 5.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 44328057 | 96446 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 986 | 26 | 9 | 9 | 4.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1cccnc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL265734 | 96446 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 986 | 26 | 9 | 9 | 4.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1cccnc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11732966 | 201481 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 5 | 1 | 5 | 5.6 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(C(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64244 | 201481 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 5 | 1 | 5 | 5.6 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(C(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 44279309 | 161268 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.5 | Cc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL414408 | 161268 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.5 | Cc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| 44334097 | 109580 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 447 | 7 | 2 | 6 | 3.7 | COc1ccc([C@@H]2c3nc(CCCO)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL323561 | 109580 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 447 | 7 | 2 | 6 | 3.7 | COc1ccc([C@@H]2c3nc(CCCO)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44371460 | 49265 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 469 | 5 | 1 | 7 | 4.9 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL156539 | 49265 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 469 | 5 | 1 | 7 | 4.9 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2oc3ccccc3c21 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL319537 | 209473 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 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](N)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10815005 | 9656 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 6 | 1 | 6 | 5.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(-c3ccccc3)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL11345 | 9656 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 492 | 6 | 1 | 6 | 5.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(-c3ccccc3)cc2)cc1 | 10.1021/jm9606507 | ||
| 54587165 | 59990 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 675 | 15 | 5 | 4 | 5.9 | CCCCCC[C@@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL1744023 | 59990 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 675 | 15 | 5 | 4 | 5.9 | CCCCCC[C@@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL315047 | 209440 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 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](Cc1ccc2ccccc2c1)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/jm00070a001 | ||||
| 44295114 | 14711 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 556 | 11 | 1 | 9 | 5.3 | COc1cc(C/C(C(=O)c2ccc(OC(F)F)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1207717 | 14711 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 556 | 11 | 1 | 9 | 5.3 | COc1cc(C/C(C(=O)c2ccc(OC(F)F)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL433090 | 14711 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 556 | 11 | 1 | 9 | 5.3 | COc1cc(C/C(C(=O)c2ccc(OC(F)F)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| 10768294 | 14419 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 10 | 1 | 8 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| CHEMBL10922 | 14419 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 10 | 1 | 8 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| CHEMBL1204674 | 14419 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 10 | 1 | 8 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| 19010490 | 53253 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 648 | 13 | 1 | 9 | 6.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)C(C)C)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL16018 | 53253 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 648 | 13 | 1 | 9 | 6.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)C(C)C)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 44368480 | 44356 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 495 | 13 | 1 | 7 | 4.4 | COc1ccc(CC(C(=O)O)N(Cc2ccc(OC)cc2)Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152034 | 44356 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 495 | 13 | 1 | 7 | 4.4 | COc1ccc(CC(C(=O)O)N(Cc2ccc(OC)cc2)Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 10837347 | 8781 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.3 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL109736 | 8781 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.3 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10841134 | 60127 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 589 | 10 | 4 | 6 | 5.3 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC23CC4CC(CC(C4)C2)C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL175277 | 60127 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 589 | 10 | 4 | 6 | 5.3 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC23CC4CC(CC(C4)C2)C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL414165 | 211367 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](c2cccs2)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 159594 | 518 | 38 | None | - | 3 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm9505369 | ||
| 3487 | 518 | 38 | None | - | 3 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm9505369 | ||
| CHEMBL9194 | 518 | 38 | None | - | 3 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm9505369 | ||
| DB06199 | 518 | 38 | None | - | 3 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm9505369 | ||
| 44439111 | 96728 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 979 | 31 | 2 | 15 | 7.0 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOc2ccc(CC(=O)N(C)Cc3cc(-c4ncco4)ccc3-c3ccccc3S(=O)(=O)Nc3ccno3)cc2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL268201 | 96728 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 979 | 31 | 2 | 15 | 7.0 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOc2ccc(CC(=O)N(C)Cc3cc(-c4ncco4)ccc3-c3ccccc3S(=O)(=O)Nc3ccno3)cc2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| 10622380 | 100985 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 7 | 3.9 | COc1cccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| CHEMBL297679 | 100985 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 7 | 3.9 | COc1cccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c1 | 10.1021/jm9700068 | ||
| 21041372 | 81288 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 687 | 14 | 2 | 12 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(N2CCOCC2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163725 | 81288 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 687 | 14 | 2 | 12 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(N2CCOCC2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 71462246 | 81279 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 604 | 12 | 2 | 12 | 2.6 | CNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163717 | 81279 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 604 | 12 | 2 | 12 | 2.6 | CNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 3951 | 388 | 82 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 4337 | 388 | 82 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 6918493 | 388 | 82 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL1111 | 388 | 82 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| DB06403 | 388 | 82 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44384766 | 59353 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 532 | 10 | 1 | 10 | 4.1 | C#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL172184 | 59353 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 532 | 10 | 1 | 10 | 4.1 | C#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10576888 | 170278 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 485 | 6 | 3 | 7 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2C(=O)O)c1Br | 10.1021/jm9608366 | ||
| CHEMBL44539 | 170278 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 485 | 6 | 3 | 7 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2C(=O)O)c1Br | 10.1021/jm9608366 | ||
| 10211781 | 129219 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367453 | 129219 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 73669820 | 117125 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 462 | 10 | 1 | 7 | 5.5 | CC(=O)c1ccc(OCc2ccc3nsnc3c2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL3400989 | 117125 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 462 | 10 | 1 | 7 | 5.5 | CC(=O)c1ccc(OCc2ccc3nsnc3c2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| 10697883 | 11135 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 548 | 8 | 3 | 10 | 2.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CNS(C)(=O)=O)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL1178885 | 11135 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 548 | 8 | 3 | 10 | 2.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CNS(C)(=O)=O)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL47828 | 11135 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 548 | 8 | 3 | 10 | 2.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CNS(C)(=O)=O)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 137639474 | 156355 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 607 | 10 | 2 | 9 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CCCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4072165 | 156355 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 607 | 10 | 2 | 9 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CCCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 52949155 | 18227 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 557 | 10 | 2 | 7 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271640 | 18227 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 557 | 10 | 2 | 7 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10122495 | 30655 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 665 | 12 | 1 | 10 | 6.4 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOCc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL139734 | 30655 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 665 | 12 | 1 | 10 | 6.4 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOCc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 9870117 | 193217 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 10 | 1 | 7 | 5.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54057 | 193217 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 10 | 1 | 7 | 5.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 9870117 | 193217 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 10 | 1 | 7 | 5.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC=O)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL54057 | 193217 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 488 | 10 | 1 | 7 | 5.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC=O)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9831249 | 59385 | 0 | None | - | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 672 | 14 | 2 | 10 | 6.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172297 | 59385 | 0 | None | - | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 672 | 14 | 2 | 10 | 6.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10720982 | 127295 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 4.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL121647 | 127295 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 4.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL366441 | 127295 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 530 | 9 | 2 | 6 | 4.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)C)cc1 | 10.1021/jm990171i | ||
| 44314889 | 103267 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 633 | 12 | 5 | 4 | 4.7 | CCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL308815 | 103267 | 0 | None | - | 0 | Pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 633 | 12 | 5 | 4 | 4.7 | CCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 9808545 | 11347 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 11 | 2 | 7 | 5.2 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180353 | 11347 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 11 | 2 | 7 | 5.2 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| CHEMBL123408 | 11347 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 588 | 11 | 2 | 7 | 5.2 | COCCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)C(C)(C)C)cc1 | 10.1021/jm990171i | ||
| 44314579 | 102444 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL306123 | 102444 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| 44283270 | 167318 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL431124 | 167318 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCC[C@H](NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL414047 | 211357 | 0 | None | - | 0 | Bovine | 8.6 | pIC50 | = | 8.6 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2c[nH]cn2)C(=O)NCC(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N2CCC[C@@H]2C(=O)N1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(97)00296-5 | ||||
| 44314750 | 165100 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL424422 | 165100 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44283419 | 99853 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCC[C@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL289349 | 99853 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCC[C@H](NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 10603546 | 109958 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCC)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL324639 | 109958 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 592 | 15 | 1 | 7 | 5.0 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCC)c(F)c1 | 10.1021/jm970101g | ||
| 10625694 | 11341 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 516 | 9 | 2 | 6 | 4.5 | CCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL1180344 | 11341 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 516 | 9 | 2 | 6 | 4.5 | CCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL123107 | 11341 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 516 | 9 | 2 | 6 | 4.5 | CCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| 11123269 | 204577 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 452 | 6 | 1 | 5 | 5.8 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL87070 | 204577 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 452 | 6 | 1 | 5 | 5.8 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44314664 | 202990 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 615 | 12 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CCCC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL74000 | 202990 | 0 | None | - | 0 | Pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 615 | 12 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CCCC1)C(=O)O | 10.1021/jm9600914 | ||
| 10555516 | 9151 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 598 | 12 | 1 | 7 | 4.6 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)Cc1ccccc1 | 10.1021/jm970101g | ||
| CHEMBL110700 | 9151 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 598 | 12 | 1 | 7 | 4.6 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1)S(=O)(=O)Cc1ccccc1 | 10.1021/jm970101g | ||
| 44314904 | 102672 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 585 | 12 | 5 | 5 | 3.6 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL307936 | 102672 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 585 | 12 | 5 | 5 | 3.6 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| 44314905 | 203338 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 567 | 12 | 5 | 4 | 4.0 | CCCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL77083 | 203338 | 0 | None | - | 0 | Pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 567 | 12 | 5 | 4 | 4.0 | CCCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| 10649119 | 11333 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 8 | 2 | 6 | 4.1 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180318 | 11333 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 8 | 2 | 6 | 4.1 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL121761 | 11333 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 8 | 2 | 6 | 4.1 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL317099 | 209452 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)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/jm00015a003 | ||||
| 44298382 | 193442 | 0 | None | - | 0 | Pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 11 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54998 | 193442 | 0 | None | - | 0 | Pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 11 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 10792316 | 167917 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 530 | 8 | 2 | 6 | 5.3 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C)cccc2C(C)C)cc1 | 10.1021/jm990170q | ||
| CHEMBL435185 | 167917 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 530 | 8 | 2 | 6 | 5.3 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C)cccc2C(C)C)cc1 | 10.1021/jm990170q | ||
| CHEMBL313984 | 209377 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| 56671734 | 62999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 937 | 26 | 9 | 9 | 3.6 | CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC | 10.1021/jm970161m | ||
| CHEMBL1793932 | 62999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 937 | 26 | 9 | 9 | 3.6 | CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC | 10.1021/jm970161m | ||
| 44284236 | 121809 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 504 | 9 | 3 | 7 | 4.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCCO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL35984 | 121809 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 504 | 9 | 3 | 7 | 4.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCCO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 21462927 | 119737 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 7 | 1 | 8 | 5.1 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc([N+](=O)[O-])ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL352241 | 119737 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 7 | 1 | 8 | 5.1 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc([N+](=O)[O-])ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 9825494 | 200923 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL61211 | 200923 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccc(C2=C(C(=O)O)[C@@H](c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 10896413 | 100141 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.4 | COc1ccc(CCOC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL291841 | 100141 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.4 | COc1ccc(CCOC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 11755275 | 198326 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 489 | 9 | 1 | 7 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)c(=O)n2Cc1cc(OC)ccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL59537 | 198326 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 489 | 9 | 1 | 7 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)c(=O)n2Cc1cc(OC)ccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| 10627272 | 202358 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 592 | 12 | 1 | 11 | 4.2 | COC(=O)CCCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| CHEMBL69986 | 202358 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 592 | 12 | 1 | 11 | 4.2 | COC(=O)CCCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| 44311527 | 202423 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 675 | 12 | 2 | 11 | 7.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2cccs2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70365 | 202423 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 675 | 12 | 2 | 11 | 7.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2cccs2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 44327868 | 110956 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 906 | 24 | 9 | 8 | 3.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC12CC3CC(CC(C3)C1)C2)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/jm00015a003 | ||
| CHEMBL327523 | 110956 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 906 | 24 | 9 | 8 | 3.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC12CC3CC(CC(C3)C1)C2)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/jm00015a003 | ||
| 10791694 | 97748 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(OC)c2OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL274175 | 97748 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(OC)c2OC)cc1 | 10.1021/jm9606507 | ||
| 9934580 | 162380 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 474 | 6 | 1 | 8 | 3.6 | COC(=O)c1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL417428 | 162380 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 474 | 6 | 1 | 8 | 3.6 | COC(=O)c1ccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| 10765057 | 162610 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 1 | 7 | 3.5 | O=C1OC(O)(c2ccc3c(c2)OCO3)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| CHEMBL417978 | 162610 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 4 | 1 | 7 | 3.5 | O=C1OC(O)(c2ccc3c(c2)OCO3)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| 19735343 | 175477 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 473 | 7 | 2 | 6 | 4.0 | O=S(=O)(Nc1ncnc(OCCO)c1-c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4590568 | 175477 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 473 | 7 | 2 | 6 | 4.0 | O=S(=O)(Nc1ncnc(OCCO)c1-c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL86814 | 214115 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 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](Cc1ccccc1)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/jm00070a001 | ||||
| CHEMBL1791279 | 207176 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)[C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 44383753 | 59751 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 5 | 1 | 5 | 5.7 | Cc1cc(C)c(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL173761 | 59751 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 5 | 1 | 5 | 5.7 | Cc1cc(C)c(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44327661 | 164038 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 483 | 5 | 1 | 8 | 2.7 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL421563 | 164038 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 483 | 5 | 1 | 8 | 2.7 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44316515 | 203295 | 2 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 360 | 4 | 1 | 5 | 2.9 | COc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76779 | 203295 | 2 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 360 | 4 | 1 | 5 | 2.9 | COc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 18617288 | 203436 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 316 | 3 | 1 | 4 | 2.5 | Cc1noc(NS(=O)(=O)c2ccccc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78080 | 203436 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 316 | 3 | 1 | 4 | 2.5 | Cc1noc(NS(=O)(=O)c2ccccc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 11800804 | 161287 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 550 | 10 | 4 | 5 | 4.7 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N(C)C2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL414605 | 161287 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 550 | 10 | 4 | 5 | 4.7 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N(C)C2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.5b01781 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.5b01781 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.5b01781 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/acs.jmedchem.5b01781 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm3009103 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm3009103 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm3009103 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm3009103 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm3009103 | ||
| 10122033 | 81265 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 631 | 15 | 1 | 13 | 4.0 | COc1cnc(OCCOc2nc(-c3ncccn3)nc(NS(=O)(=O)CCc3ccccc3)c2Oc2ccccc2OC)nc1 | 10.1021/jm3009103 | ||
| CHEMBL2163703 | 81265 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 631 | 15 | 1 | 13 | 4.0 | COc1cnc(OCCOc2nc(-c3ncccn3)nc(NS(=O)(=O)CCc3ccccc3)c2Oc2ccccc2OC)nc1 | 10.1021/jm3009103 | ||
| 58688005 | 174388 | 1 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 540 | 11 | 2 | 9 | 3.1 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4565926 | 174388 | 1 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 540 | 11 | 2 | 9 | 3.1 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10144372 | 165501 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 562 | 10 | 2 | 11 | 3.4 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ncccn2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL425682 | 165501 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 562 | 10 | 2 | 11 | 3.4 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ncccn2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 22467229 | 98500 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 7 | 2 | 7 | 4.1 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(CN)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL279703 | 98500 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 7 | 2 | 7 | 4.1 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(CN)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 44320338 | 106491 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 490 | 7 | 2 | 6 | 5.0 | O=C(O)c1ccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)cc1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315087 | 106491 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 490 | 7 | 2 | 6 | 5.0 | O=C(O)c1ccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)cc1 | 10.1016/s0960-894x(00)00513-8 | ||
| 10281192 | 60751 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 11 | 2 | 10 | 4.2 | C#CCOc1nc(-c2ccnc(CO)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176482 | 60751 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 11 | 2 | 10 | 4.2 | C#CCOc1nc(-c2ccnc(CO)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10211543 | 130863 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 640 | 13 | 2 | 12 | 3.5 | CCCCNC(=O)OCC#CCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368989 | 130863 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 640 | 13 | 2 | 12 | 3.5 | CCCCNC(=O)OCC#CCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 71462245 | 81254 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 588 | 13 | 2 | 10 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1cc(OC)ccc1Cl | 10.1021/jm3009103 | ||
| CHEMBL2163692 | 81254 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 588 | 13 | 2 | 10 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1cc(OC)ccc1Cl | 10.1021/jm3009103 | ||
| 44177614 | 129129 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 547 | 10 | 1 | 9 | 5.4 | C=CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367339 | 129129 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 547 | 10 | 1 | 9 | 5.4 | C=CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10479787 | 59303 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.3 | Cc1cc(C)c(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL171972 | 59303 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 5.3 | Cc1cc(C)c(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 151174 | 201032 | 37 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 605 | 12 | 3 | 13 | 3.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccnc(-c3nn[nH]n3)c2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL61780 | 201032 | 37 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 605 | 12 | 3 | 13 | 3.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccnc(-c3nn[nH]n3)c2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| 44334130 | 4442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 458 | 5 | 1 | 6 | 4.4 | COc1ccc([C@@H]2c3nc(N4CCCC4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102173 | 4442 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 458 | 5 | 1 | 6 | 4.4 | COc1ccc([C@@H]2c3nc(N4CCCC4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 10745564 | 6148 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 566 | 11 | 1 | 7 | 4.4 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccccc1 | 10.1021/jm970101g | ||
| CHEMBL108142 | 6148 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 566 | 11 | 1 | 7 | 4.4 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccccc1 | 10.1021/jm970101g | ||
| CHEMBL263295 | 208820 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 44304492 | 96112 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL262993 | 96112 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 949 | 23 | 9 | 8 | 4.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 18738880 | 167611 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 8 | 2 | 7 | 4.5 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)NC)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL433221 | 167611 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 561 | 8 | 2 | 7 | 4.5 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)NC)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 21041283 | 172576 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 13 | 2 | 9 | 3.2 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(OC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4521348 | 172576 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 552 | 13 | 2 | 9 | 3.2 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(OC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10960638 | 100599 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 414 | 4 | 1 | 4 | 5.6 | CC(C)c1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL294793 | 100599 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 414 | 4 | 1 | 4 | 5.6 | CC(C)c1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| 44279371 | 99462 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 3 | 2 | 3 | 5.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3cc(Cl)cc(Cl)c3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL286214 | 99462 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 466 | 3 | 2 | 3 | 5.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3cc(Cl)cc(Cl)c3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 10814743 | 178791 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 484 | 6 | 1 | 9 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C2(Cc3ccc4c(c3)OCO4)OCCO2)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL47383 | 178791 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 484 | 6 | 1 | 9 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C2(Cc3ccc4c(c3)OCO4)OCCO2)c1Cl | 10.1021/jm9700068 | ||
| 10555424 | 202338 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 592 | 13 | 2 | 10 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL69832 | 202338 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 592 | 13 | 2 | 10 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCCCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| 44266568 | 97646 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 6.3 | COc1ccc(-c2c(C(=O)O)n(-c3ccc4c(c3)OCO4)c3ccc(OCc4ccccc4)cc23)cc1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL273410 | 97646 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 493 | 7 | 1 | 6 | 6.3 | COc1ccc(-c2c(C(=O)O)n(-c3ccc4c(c3)OCO4)c3ccc(OCc4ccccc4)cc23)cc1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL133257 | 206973 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](C2CCCC2)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 44383537 | 58937 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 388 | 4 | 2 | 5 | 3.4 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| CHEMBL170335 | 58937 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 388 | 4 | 2 | 5 | 3.4 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| 10648937 | 205575 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9334 | 205575 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44385412 | 130856 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 711 | 14 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(Cc2ccc3c(c2)OCO3)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368945 | 130856 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 711 | 14 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(Cc2ccc3c(c2)OCO3)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 23445358 | 111075 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1cccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL328089 | 111075 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1cccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| 44352079 | 116041 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 494 | 11 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)cc1 | 10.1021/jm010237l | ||
| CHEMBL336272 | 116041 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 494 | 11 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)cc1 | 10.1021/jm010237l | ||
| 137649809 | 156845 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 583 | 10 | 2 | 7 | 5.9 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CCCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4078297 | 156845 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 583 | 10 | 2 | 7 | 5.9 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CCCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 23548253 | 81264 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 679 | 14 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2163702 | 81264 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 679 | 14 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 23548253 | 81264 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 679 | 14 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163702 | 81264 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 679 | 14 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 76330201 | 84925 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 526 | 6 | 1 | 7 | 4.5 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(Cl)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261363 | 84925 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 526 | 6 | 1 | 7 | 4.5 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(Cl)ccc12 | 10.1007/s00044-004-0021-y | ||
| 44214320 | 84926 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 6 | 1 | 7 | 4.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(F)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261364 | 84926 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 6 | 1 | 7 | 4.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(F)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2304017 | 207728 | 0 | None | - | 0 | Pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CSC(C)(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(C#N)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 11059576 | 201602 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL64726 | 201602 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 44295097 | 14594 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 604 | 13 | 1 | 9 | 7.0 | COc1ccc(C(=O)/C(Cc2cc(OC(C)C)c(OC(C)C)c(OC(C)C)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206461 | 14594 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 604 | 13 | 1 | 9 | 7.0 | COc1ccc(C(=O)/C(Cc2cc(OC(C)C)c(OC(C)C)c(OC(C)C)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL276362 | 14594 | 0 | None | - | 0 | Pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 604 | 13 | 1 | 9 | 7.0 | COc1ccc(C(=O)/C(Cc2cc(OC(C)C)c(OC(C)C)c(OC(C)C)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 11827880 | 10130 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 565 | 10 | 1 | 9 | 5.5 | CSc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| CHEMBL116046 | 10130 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 565 | 10 | 1 | 9 | 5.5 | CSc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| CHEMBL177979 | 10130 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 565 | 10 | 1 | 9 | 5.5 | CSc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| 10552548 | 98070 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OC)c2OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL276252 | 98070 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OC)c2OC)cc1 | 10.1021/jm9606507 | ||
| 11145841 | 100487 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 9 | 1 | 6 | 6.9 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC3CCCC3)cc1)O2 | 10.1021/jm010382z | ||
| CHEMBL294127 | 100487 | 0 | None | - | 0 | Pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 528 | 9 | 1 | 6 | 6.9 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC3CCCC3)cc1)O2 | 10.1021/jm010382z | ||
| 18738879 | 89802 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 548 | 8 | 2 | 7 | 4.8 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL23833 | 89802 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 548 | 8 | 2 | 7 | 4.8 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 15340617 | 98780 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 464 | 8 | 1 | 7 | 3.7 | COc1cccc(Cn2nc(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2OCC(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL281677 | 98780 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 464 | 8 | 1 | 7 | 3.7 | COc1cccc(Cn2nc(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2OCC(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 18617379 | 203513 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 364 | 3 | 1 | 4 | 3.5 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78669 | 203513 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 364 | 3 | 1 | 4 | 3.5 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44276948 | 106353 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 396 | 5 | 1 | 3 | 4.5 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc(Cl)cc3)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144604 | 106353 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 396 | 5 | 1 | 3 | 4.5 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc(Cl)cc3)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 9845967 | 10989 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10801 | 10989 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL1178000 | 10989 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL51530 | 10989 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 44385941 | 130154 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC(C)C2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368286 | 130154 | 0 | None | - | 0 | Pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC(C)C2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44266532 | 4434 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 401 | 3 | 1 | 6 | 4.5 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10211 | 4434 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 401 | 3 | 1 | 6 | 4.5 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1-c1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 10282163 | 60092 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 599 | 11 | 2 | 12 | 3.9 | C#CCOc1nc(-c2ccnc(-c3nn[nH]n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175057 | 60092 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 599 | 11 | 2 | 12 | 3.9 | C#CCOc1nc(-c2ccnc(-c3nn[nH]n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 9932004 | 97725 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCCC2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL273948 | 97725 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCCC2)cc1 | 10.1021/jm9606507 | ||
| 44458604 | 98161 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 559 | 6 | 2 | 7 | 3.7 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL276982 | 98161 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 559 | 6 | 2 | 7 | 3.7 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 44386161 | 60947 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 573 | 9 | 1 | 9 | 5.6 | CCC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176650 | 60947 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 573 | 9 | 1 | 9 | 5.6 | CCC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL2304008 | 207719 | 0 | None | - | 0 | Pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CSC(C)(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 44284391 | 138771 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 532 | 9 | 3 | 7 | 5.3 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCC(C)(C)O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL37920 | 138771 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 532 | 9 | 3 | 7 | 5.3 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CCC(C)(C)O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 18995991 | 99836 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1cc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc(OC)c1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28920 | 99836 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1cc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)cc(OC)c1OC | 10.1016/0960-894X(96)00232-6 | ||
| 44279127 | 99028 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 432 | 3 | 2 | 3 | 4.8 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(Cl)cc3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL283200 | 99028 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 432 | 3 | 2 | 3 | 4.8 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(Cl)cc3)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 19010493 | 97904 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 543 | 11 | 1 | 7 | 6.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL275179 | 97904 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 543 | 11 | 1 | 7 | 6.5 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 11048815 | 101845 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)OC(c1ccc3c(c1)OCO3)C(C(=O)O)=C2c1ccc(OC)cc1 | 10.1021/jm010382z | ||
| CHEMBL303531 | 101845 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)OC(c1ccc3c(c1)OCO3)C(C(=O)O)=C2c1ccc(OC)cc1 | 10.1021/jm010382z | ||
| 10862228 | 201272 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 7 | 1 | 6 | 4.2 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC)cc21 | 10.1021/jm010382z | ||
| CHEMBL63000 | 201272 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 7 | 1 | 6 | 4.2 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC)cc21 | 10.1021/jm010382z | ||
| 10722371 | 101758 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 11 | 1 | 11 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCN3CCOCC3)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL302974 | 101758 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 11 | 1 | 11 | 3.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCN3CCOCC3)c2)cc1 | 10.1021/jm980504w | ||
| 44316768 | 203532 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 358 | 4 | 1 | 4 | 3.4 | CCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78830 | 203532 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 358 | 4 | 1 | 4 | 3.4 | CCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 443289 | 703 | 40 | None | - | 3 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 997 | 703 | 40 | None | - | 3 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| CHEMBL314691 | 703 | 40 | None | - | 3 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| DB12054 | 703 | 40 | None | - | 3 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 10478562 | 131276 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 4.5 | Cc1ccc(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL369359 | 131276 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 4.5 | Cc1ccc(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00132-7 | ||
| 10717279 | 96600 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 425 | 9 | 1 | 5 | 4.8 | CCCCCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266996 | 96600 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 425 | 9 | 1 | 5 | 4.8 | CCCCCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10122675 | 98020 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 682 | 12 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL275897 | 98020 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 682 | 12 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10742024 | 96495 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 446 | 7 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCc2ccccn2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266143 | 96495 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 446 | 7 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCc2ccccn2)cc1 | 10.1021/jm9505369 | ||
| 135884434 | 130043 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 628 | 10 | 2 | 12 | 5.2 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368117 | 130043 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 628 | 10 | 2 | 12 | 5.2 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 9810571 | 61057 | 0 | None | - | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 731 | 18 | 2 | 13 | 5.0 | CCCS(=O)(=O)NCCOc1nc(-c2cc(OC)c(OC)c(OC)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL176997 | 61057 | 0 | None | - | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 731 | 18 | 2 | 13 | 5.0 | CCCS(=O)(=O)NCCOc1nc(-c2cc(OC)c(OC)c(OC)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 18184194 | 130040 | 0 | None | - | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 712 | 15 | 2 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368107 | 130040 | 0 | None | - | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 712 | 15 | 2 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44368819 | 168326 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1637 | 31 | 19 | 20 | 1.7 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| 77282140 | 168326 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1637 | 31 | 19 | 20 | 1.7 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| CHEMBL438380 | 168326 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 1637 | 31 | 19 | 20 | 1.7 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| 10815823 | 9704 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 520 | 8 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1C | 10.1021/jm9606507 | ||
| CHEMBL11369 | 9704 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 520 | 8 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1C | 10.1021/jm9606507 | ||
| 44298304 | 101085 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 10 | 2 | 7 | 4.7 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(N)=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL298395 | 101085 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 503 | 10 | 2 | 7 | 4.7 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(N)=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44298409 | 193328 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 490 | 10 | 2 | 7 | 5.2 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54770 | 193328 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 490 | 10 | 2 | 7 | 5.2 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL2304018 | 207729 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Cl)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 76319370 | 84932 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 8 | 1 | 9 | 4.0 | CCOC(=O)c1ccc2c(C(C(=O)NS(=O)(=O)c3ccc(C)cc3OC)c3ccc4c(c3)OCO4)cn(C)c2c1 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261602 | 84932 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 8 | 1 | 9 | 4.0 | CCOC(=O)c1ccc2c(C(C(=O)NS(=O)(=O)c3ccc(C)cc3OC)c3ccc4c(c3)OCO4)cn(C)c2c1 | 10.1007/s00044-004-0021-y | ||
| 10886132 | 9716 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 10 | 1 | 9 | 4.8 | COc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| CHEMBL113757 | 9716 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 10 | 1 | 9 | 4.8 | COc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| CHEMBL368796 | 9716 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 549 | 10 | 1 | 9 | 4.8 | COc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1 | 10.1021/jm0102304 | ||
| 10440821 | 205804 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 918 | 24 | 9 | 8 | 4.1 | 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(C)c(C)c(C)c(C)c1C)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/jm00015a003 | ||
| CHEMBL94689 | 205804 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 918 | 24 | 9 | 8 | 4.1 | 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(C)c(C)c(C)c(C)c1C)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/jm00015a003 | ||
| 44279351 | 99482 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.5 | Cc1ccccc1-c1ccc2c(c1)C(=O)c1ccccc1[C@@H]1[C@H](C(=O)O)[C@H](C(=O)O)[C@H]21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL286333 | 99482 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.5 | Cc1ccccc1-c1ccc2c(c1)C(=O)c1ccccc1[C@@H]1[C@H](C(=O)O)[C@H](C(=O)O)[C@H]21 | 10.1016/0960-894X(95)00230-Q | ||
| 44279129 | 106512 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1ccccc1-c1ccc2c(c1)C(=O)c1ccccc1[C@@H]1[C@H](C(=O)O)[C@H](C(=O)O)[C@H]21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL31524 | 106512 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1ccccc1-c1ccc2c(c1)C(=O)c1ccccc1[C@@H]1[C@H](C(=O)O)[C@H](C(=O)O)[C@H]21 | 10.1016/0960-894X(95)00230-Q | ||
| 22998446 | 106150 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)s2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL314320 | 106150 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)s2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 44277263 | 106354 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3cc4c(cc3Cl)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144605 | 106354 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3cc4c(cc3Cl)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10744085 | 102397 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 503 | 9 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OCCN(C)C)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL305777 | 102397 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 503 | 9 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OCCN(C)C)c2)cc1 | 10.1021/jm980504w | ||
| 44327727 | 167634 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 503 | 6 | 1 | 8 | 3.0 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL433373 | 167634 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 503 | 6 | 1 | 8 | 3.0 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44386536 | 130191 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.9 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2F)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368461 | 130191 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.9 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2F)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44266655 | 4974 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 445 | 5 | 1 | 7 | 4.5 | COc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10523 | 4974 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 445 | 5 | 1 | 7 | 4.5 | COc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 18617363 | 164008 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL421523 | 164008 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 5344 | 172901 | 98 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 267 | 3 | 2 | 5 | 1.7 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL453 | 172901 | 98 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 267 | 3 | 2 | 5 | 1.7 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 15453210 | 203535 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 5 | 1 | 6 | 2.6 | COc1ccc(S(=O)(=O)Nc2onc(C)c2Br)cc1OC | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78853 | 203535 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 5 | 1 | 6 | 2.6 | COc1ccc(S(=O)(=O)Nc2onc(C)c2Br)cc1OC | 10.1016/0960-894X(96)00441-6 | ||
| 44276596 | 106359 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 458 | 8 | 1 | 6 | 4.2 | COc1ccc(Cc2[nH]n(Cc3cccc(OC)c3)c(=O)c2Cc2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144728 | 106359 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 458 | 8 | 1 | 6 | 4.2 | COc1ccc(Cc2[nH]n(Cc3cccc(OC)c3)c(=O)c2Cc2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| 44276907 | 106372 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 4 | 1 | 4 | 3.6 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccccc1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144845 | 106372 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 4 | 1 | 4 | 3.6 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccccc1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10146377 | 60093 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 662 | 11 | 2 | 14 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175058 | 60093 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 662 | 11 | 2 | 14 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cnccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 71449713 | 81256 | 21 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 585 | 11 | 1 | 8 | 4.5 | CCCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2163694 | 81256 | 21 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 585 | 11 | 1 | 8 | 4.5 | CCCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 10575061 | 205166 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 439 | 9 | 1 | 6 | 4.0 | CCCCC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9082 | 205166 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 439 | 9 | 1 | 6 | 4.0 | CCCCC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 22467266 | 84922 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261360 | 84922 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| 23445366 | 105702 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 6.2 | Cc1cc(CCC(C)C)ccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL313801 | 105702 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 6.2 | Cc1cc(CCC(C)C)ccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL2370070 | 208034 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| 71455140 | 81596 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 598 | 12 | 2 | 8 | 4.7 | CC(C)c1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165336 | 81596 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 598 | 12 | 2 | 8 | 4.7 | CC(C)c1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| 71456865 | 81290 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 632 | 14 | 2 | 11 | 3.7 | COc1nc(NS(=O)(=O)NCc2ccccc2)c(Oc2ccccc2OC)c(OCCOc2ncc(Br)cn2)n1 | 10.1021/jm3009103 | ||
| CHEMBL2163727 | 81290 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 632 | 14 | 2 | 11 | 3.7 | COc1nc(NS(=O)(=O)NCc2ccccc2)c(Oc2ccccc2OC)c(OCCOc2ncc(Br)cn2)n1 | 10.1021/jm3009103 | ||
| 44284405 | 99892 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 532 | 10 | 2 | 7 | 5.4 | COCC(C)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL289634 | 99892 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 532 | 10 | 2 | 7 | 5.4 | COCC(C)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| 44284328 | 127019 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL36627 | 127019 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 9939238 | 202428 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 637 | 12 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70385 | 202428 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 637 | 12 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 44311345 | 202516 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 663 | 13 | 3 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CCNCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70895 | 202516 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 663 | 13 | 3 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CCNCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL85341 | 214111 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | 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](Cc1ccc(O)cc1)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/jm00070a001 | ||||
| 15411009 | 106706 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 691 | 14 | 1 | 12 | 5.6 | CCOC(=O)C(CC(C)C)NC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL316523 | 106706 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 691 | 14 | 1 | 12 | 5.6 | CCOC(=O)C(CC(C)C)NC(=O)OC1(c2ccc(OC)cc2)OC(=O)C(c2ccc3c(c2)OCO3)=C1Cc1cc(OC)c(OC)c(OC)c1 | 10.1016/S0960-894X(97)00002-4 | ||
| 10938122 | 162456 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.8 | CC(C)Oc1ccc2c(c1)C(C(C)C)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL417555 | 162456 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.8 | CC(C)Oc1ccc2c(c1)C(C(C)C)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 135415889 | 58957 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 587 | 10 | 2 | 13 | 3.6 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL170401 | 58957 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 587 | 10 | 2 | 13 | 3.6 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 44266542 | 162260 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 521 | 7 | 1 | 7 | 6.1 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc(OCc3ccccc3)ccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL417246 | 162260 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 521 | 7 | 1 | 7 | 6.1 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc(OCc3ccccc3)ccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 18617351 | 103632 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL309397 | 103632 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 18617407 | 203272 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76576 | 203272 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10788853 | 6033 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc(OC)cc3OC)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10808 | 6033 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc(OC)cc3OC)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 10766396 | 110090 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 460 | 8 | 1 | 4 | 4.6 | CCCN(C)C(=O)CN1C[C@H](c2ccc3ccccc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL325418 | 110090 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 460 | 8 | 1 | 4 | 4.6 | CCCN(C)C(=O)CN1C[C@H](c2ccc3ccccc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 44276886 | 106350 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 4.2 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccccc1Cl | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144600 | 106350 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 410 | 4 | 1 | 4 | 4.2 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1ccccc1Cl | 10.1016/s0960-894x(00)00232-8 | ||
| 44459272 | 90809 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 491 | 6 | 2 | 7 | 2.6 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccccc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL24015 | 90809 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 491 | 6 | 2 | 7 | 2.6 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccccc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 10279940 | 100881 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 527 | 8 | 2 | 10 | 3.6 | CC(=O)OCCc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| CHEMBL296927 | 100881 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 527 | 8 | 2 | 10 | 3.6 | CC(=O)OCCc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| 10504920 | 162560 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 480 | 6 | 2 | 9 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CC#N)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL417719 | 162560 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 480 | 6 | 2 | 9 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CC#N)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 44384611 | 128132 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 644 | 10 | 2 | 12 | 5.8 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL366797 | 128132 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 644 | 10 | 2 | 12 | 5.8 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 44314647 | 203376 | 0 | None | - | 0 | Pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL77468 | 203376 | 0 | None | - | 0 | Pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 647 | 13 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| 10745418 | 113493 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 558 | 9 | 2 | 6 | 6.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 | 10.1021/jm990170q | ||
| CHEMBL332627 | 113493 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 558 | 9 | 2 | 6 | 6.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 | 10.1021/jm990170q | ||
| 44320461 | 105868 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 514 | 6 | 1 | 5 | 6.6 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL313920 | 105868 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 514 | 6 | 1 | 5 | 6.6 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 10118046 | 9345 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 504 | 10 | 1 | 7 | 2.9 | CCCS(=O)(=O)N(C)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL111728 | 9345 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 504 | 10 | 1 | 7 | 2.9 | CCCS(=O)(=O)N(C)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 44327659 | 109334 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 937 | 26 | 9 | 8 | 4.6 | CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(c1ccccc1)c1ccccc1 | 10.1021/jm00015a003 | ||
| CHEMBL323331 | 109334 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 937 | 26 | 9 | 8 | 4.6 | CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(c1ccccc1)c1ccccc1 | 10.1021/jm00015a003 | ||
| CHEMBL96822 | 214143 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | 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](NS(C)(=O)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10789524 | 5121 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10607 | 5121 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cccc(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 10530409 | 5630 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 9 | 1 | 10 | 3.9 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10781 | 5630 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 536 | 9 | 1 | 10 | 3.9 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 73669821 | 117124 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 448 | 10 | 1 | 6 | 5.2 | CC(=O)c1ccc(OCc2ccc3c(c2)OCO3)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL3400988 | 117124 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 448 | 10 | 1 | 6 | 5.2 | CC(=O)c1ccc(OCc2ccc3c(c2)OCO3)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| 44295177 | 14612 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 534 | 10 | 1 | 9 | 5.0 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1C | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206680 | 14612 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 534 | 10 | 1 | 9 | 5.0 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1C | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL295483 | 14612 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 534 | 10 | 1 | 9 | 5.0 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1C | 10.1016/s0960-894x(98)00301-1 | ||
| 10789525 | 61441 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 446 | 8 | 1 | 6 | 4.4 | COc1ccc(C(=O)/C(Cc2cccc(OC)c2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm031041j | ||
| CHEMBL177221 | 61441 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 446 | 8 | 1 | 6 | 4.4 | COc1ccc(C(=O)/C(Cc2cccc(OC)c2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm031041j | ||
| 10346184 | 9106 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL110366 | 9106 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL315328 | 209443 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | 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)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL87252 | 214117 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00070a001 | ||||
| 18936171 | 194831 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 489 | 7 | 1 | 8 | 4.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2c(OC)c(OC)ccc21 | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL56348 | 194831 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 489 | 7 | 1 | 8 | 4.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2c(OC)c(OC)ccc21 | 10.1016/S0960-894X(97)00319-3 | ||
| 44327252 | 205800 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 7 | 1 | 8 | 3.1 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)n2nc(C3CC3)ccc2=O)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94654 | 205800 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 7 | 1 | 8 | 3.1 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)n2nc(C3CC3)ccc2=O)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44327226 | 206178 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 497 | 7 | 1 | 8 | 3.1 | CCc1cc(C)nn(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c1=O | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL96762 | 206178 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 497 | 7 | 1 | 8 | 3.1 | CCc1cc(C)nn(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c1=O | 10.1016/S0960-894X(96)00617-8 | ||
| 22616258 | 104927 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 372 | 5 | 1 | 4 | 3.8 | CCCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311781 | 104927 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 372 | 5 | 1 | 4 | 3.8 | CCCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 9870959 | 8829 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| CHEMBL109778 | 8829 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| 10625152 | 109970 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 498 | 13 | 1 | 6 | 4.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccoc1 | 10.1021/jm980217s | ||
| CHEMBL324685 | 109970 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 498 | 13 | 1 | 6 | 4.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccoc1 | 10.1021/jm980217s | ||
| 44386621 | 60948 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL176653 | 60948 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| 11801544 | 61448 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 589 | 10 | 4 | 6 | 5.1 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2C3CC4CC(C3)CC2C4)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL177261 | 61448 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 589 | 10 | 4 | 6 | 5.1 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2C3CC4CC(C3)CC2C4)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44385805 | 60967 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 532 | 10 | 1 | 10 | 4.1 | C#CCOc1nc(-c2cnccn2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176698 | 60967 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 532 | 10 | 1 | 10 | 4.1 | C#CCOc1nc(-c2cnccn2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10552413 | 110179 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 472 | 13 | 1 | 5 | 4.7 | C/C=C\CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL325935 | 110179 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 472 | 13 | 1 | 5 | 4.7 | C/C=C\CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 10346184 | 9106 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL110366 | 9106 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| 21462925 | 119434 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 470 | 6 | 2 | 7 | 4.8 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(N)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL349556 | 119434 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 470 | 6 | 2 | 7 | 4.8 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(N)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL2304011 | 207722 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | Cc1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@@H](C2CC2)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC1=O | 10.1021/jm9600914 | ||||
| CHEMBL2369709 | 207907 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 44371421 | 51160 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 459 | 5 | 1 | 5 | 5.8 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3Cl)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL158204 | 51160 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 459 | 5 | 1 | 5 | 5.8 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3Cl)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 10412464 | 9049 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.4 | COc1ccc(CC2=C(c3ccc(Cl)c(Cl)c3)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10996 | 9049 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 470 | 6 | 1 | 5 | 5.4 | COc1ccc(CC2=C(c3ccc(Cl)c(Cl)c3)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| 10961720 | 201791 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 472 | 6 | 1 | 5 | 6.3 | CC(C)Oc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(C(C)C)cc1)O2 | 10.1021/jm010382z | ||
| CHEMBL66094 | 201791 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 472 | 6 | 1 | 5 | 6.3 | CC(C)Oc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(C(C)C)cc1)O2 | 10.1021/jm010382z | ||
| 44314461 | 203071 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 13 | 5 | 4 | 3.9 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL74837 | 203071 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 13 | 5 | 4 | 3.9 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCC1)C(=O)O | 10.1021/jm9600914 | ||
| 10767778 | 16225 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cc(C)cc(C)c2)cc1 | 10.1021/jm990170q | ||
| CHEMBL123077 | 16225 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cc(C)cc(C)c2)cc1 | 10.1021/jm990170q | ||
| 10216862 | 194738 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 443 | 4 | 1 | 7 | 3.9 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n(Cc2ccc3c(c2)OCO3)c1=O | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL56286 | 194738 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 443 | 4 | 1 | 7 | 3.9 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n(Cc2ccc3c(c2)OCO3)c1=O | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL265066 | 96367 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 646 | 8 | 2 | 13 | 5.8 | COC(=O)C1=C(C)N=C(C)/C(=C(/O)OC(=O)C2=C(C)N=C(C)/C(=C(/O)OC)[C@@H]2c2cccc([N+](=O)[O-])c2)[C@H]1c1cccc([N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81025-8 | ||
| 22616257 | 203305 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 272 | 3 | 1 | 4 | 2.4 | Cc1noc(NS(=O)(=O)c2ccccc2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76860 | 203305 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 272 | 3 | 1 | 4 | 2.4 | Cc1noc(NS(=O)(=O)c2ccccc2)c1Cl | 10.1016/0960-894X(96)00441-6 | ||
| 44316831 | 203804 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 358 | 4 | 1 | 4 | 3.4 | CCc1ccc(Br)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80807 | 203804 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 358 | 4 | 1 | 4 | 3.4 | CCc1ccc(Br)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 10070783 | 96609 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| CHEMBL267094 | 96609 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 4 | 1 | 5 | 4.5 | O=C1OC(O)(c2ccc(Cl)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| 10502226 | 101058 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 6 | 1 | 8 | 3.3 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1C | 10.1021/jm9700068 | ||
| CHEMBL298203 | 101058 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 6 | 1 | 8 | 3.3 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1C | 10.1021/jm9700068 | ||
| 10719007 | 11137 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 465 | 6 | 1 | 9 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)C(C#N)c2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL1178895 | 11137 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 465 | 6 | 1 | 9 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)C(C#N)c2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL48448 | 11137 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 465 | 6 | 1 | 9 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)C(C#N)c2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| 10646637 | 205319 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 437 | 8 | 1 | 5 | 4.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C/C=C/CC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9168 | 205319 | 0 | None | - | 0 | Pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 437 | 8 | 1 | 5 | 4.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C/C=C/CC(C)C)cc1 | 10.1021/jm9505369 | ||
| 10347080 | 84803 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 535 | 7 | 2 | 8 | 3.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL22562 | 84803 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 535 | 7 | 2 | 8 | 3.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| 44314646 | 203330 | 0 | None | - | 0 | Pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 633 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL77033 | 203330 | 0 | None | - | 0 | Pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 633 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCCC1)C(=O)O | 10.1021/jm9600914 | ||
| 11766844 | 109293 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 553 | 9 | 1 | 8 | 5.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Cl)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL176272 | 109293 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 553 | 9 | 1 | 8 | 5.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Cl)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL323243 | 109293 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 553 | 9 | 1 | 8 | 5.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Cl)cn2)cc1 | 10.1021/jm0102304 | ||
| 10212088 | 96248 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 688 | 12 | 2 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL264035 | 96248 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 688 | 12 | 2 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 9957883 | 98204 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL27732 | 98204 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 44279370 | 106722 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 426 | 4 | 2 | 3 | 4.7 | CCc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL31662 | 106722 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 426 | 4 | 2 | 3 | 4.7 | CCc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 11091217 | 100598 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2cc(OCCC)ccc21 | 10.1021/jm010382z | ||
| CHEMBL294787 | 100598 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2cc(OCCC)ccc21 | 10.1021/jm010382z | ||
| 11014820 | 201223 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 6 | 1 | 6 | 4.2 | CCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL62780 | 201223 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 398 | 6 | 1 | 6 | 4.2 | CCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 10894688 | 201812 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1cccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)c1 | 10.1021/jm010382z | ||
| CHEMBL66246 | 201812 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1cccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)c1 | 10.1021/jm010382z | ||
| 44298325 | 194004 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 446 | 7 | 1 | 6 | 5.5 | CCc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Sc1cccc(OC)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL55664 | 194004 | 0 | None | - | 0 | Pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 446 | 7 | 1 | 6 | 5.5 | CCc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Sc1cccc(OC)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44311218 | 102652 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1ccncc1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL307803 | 102652 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1ccncc1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10278777 | 167569 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL432974 | 167569 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| 23445284 | 112305 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 5.4 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(C(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL330674 | 112305 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 5.4 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(C(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 71455060 | 81251 | 1 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 614 | 9 | 1 | 9 | 2.9 | O=S(=O)(Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1)N1CCOCC1 | 10.1021/jm3009103 | ||
| CHEMBL2163689 | 81251 | 1 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 614 | 9 | 1 | 9 | 2.9 | O=S(=O)(Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1)N1CCOCC1 | 10.1021/jm3009103 | ||
| 44265861 | 96760 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 481 | 11 | 1 | 6 | 5.1 | CCCC(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL268433 | 96760 | 0 | None | - | 0 | Pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 481 | 11 | 1 | 6 | 5.1 | CCCC(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10553384 | 109180 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 498 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1cccn1 | 10.1021/jm980217s | ||
| CHEMBL322537 | 109180 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 498 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1cccn1 | 10.1021/jm980217s | ||
| 25211074 | 18299 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1272244 | 18299 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 25211074 | 18299 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1272244 | 18299 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 44215416 | 174508 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 649 | 11 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccnc(-c3noc(=S)[nH]3)c2)nc1OCC1CCCO1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4568468 | 174508 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 649 | 11 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccnc(-c3noc(=S)[nH]3)c2)nc1OCC1CCCO1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10205429 | 61277 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 470 | 8 | 2 | 9 | 2.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(C)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL177111 | 61277 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 470 | 8 | 2 | 9 | 2.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(C)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 23445408 | 111145 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.5 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(CC(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL328517 | 111145 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.5 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(CC(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL2304006 | 207717 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | O=C(O)C[C@H]1NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC(=O)[C@@H](C2CC2)NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C1=O | 10.1021/jm9600914 | ||||
| CHEMBL2304017 | 207728 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CSC(C)(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(C#N)[nH]c3ccccc23)NC(=O)[C@@H](C(C)C)NC1=O | 10.1021/jm9600914 | ||||
| 70240112 | 171037 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 626 | 10 | 2 | 11 | 5.0 | CC#CCOc1nc(-c2ccnc(-c3nnn[nH]3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4465332 | 171037 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 626 | 10 | 2 | 11 | 5.0 | CC#CCOc1nc(-c2ccnc(-c3nnn[nH]3)c2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 21041288 | 173354 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 526 | 10 | 2 | 9 | 2.8 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4540866 | 173354 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 526 | 10 | 2 | 9 | 2.8 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL406279 | 210855 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| 44294712 | 14623 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 566 | 11 | 1 | 9 | 5.6 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)c(F)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206722 | 14623 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 566 | 11 | 1 | 9 | 5.6 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)c(F)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL300201 | 14623 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 566 | 11 | 1 | 9 | 5.6 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)c(F)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| 44284381 | 127987 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 6 | 3 | 7 | 4.3 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL36671 | 127987 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 6 | 3 | 7 | 4.3 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 17869371 | 14620 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 478 | 8 | 1 | 7 | 4.8 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(F)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206716 | 14620 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 478 | 8 | 1 | 7 | 4.8 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(F)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL299521 | 14620 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 478 | 8 | 1 | 7 | 4.8 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(F)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 10457385 | 112191 | 0 | None | - | 1 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 469 | 6 | 1 | 8 | 2.5 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL330424 | 112191 | 0 | None | - | 1 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 469 | 6 | 1 | 8 | 2.5 | Cc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 10527706 | 96553 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266594 | 96553 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 18995990 | 98897 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc4c(cc23)OCO4)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL282426 | 98897 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 507 | 7 | 1 | 9 | 5.0 | COc1cccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc4c(cc23)OCO4)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 18617385 | 203501 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 286 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78601 | 203501 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 286 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 44277387 | 106367 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 450 | 7 | 2 | 6 | 3.0 | O=C(O)COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144800 | 106367 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 450 | 7 | 2 | 6 | 3.0 | O=C(O)COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10366742 | 106624 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.5 | CCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL316012 | 106624 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.5 | CCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| 10715441 | 175353 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 390 | 6 | 1 | 6 | 3.9 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm9700068 | ||
| CHEMBL45875 | 175353 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 390 | 6 | 1 | 6 | 3.9 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm9700068 | ||
| 10697636 | 167257 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 13 | 1 | 7 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1SCCS1 | 10.1021/jm980217s | ||
| CHEMBL430683 | 167257 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 13 | 1 | 7 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1SCCS1 | 10.1021/jm980217s | ||
| 135512539 | 127952 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 615 | 11 | 2 | 13 | 4.4 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL366652 | 127952 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 615 | 11 | 2 | 13 | 4.4 | C#CCOc1nc(-c2ccnc(-c3noc(O)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10529715 | 205421 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)CC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9228 | 205421 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)CC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44384852 | 59924 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 544 | 9 | 1 | 8 | 5.5 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL174094 | 59924 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 544 | 9 | 1 | 8 | 5.5 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL67074 | 201920 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 646 | 8 | 2 | 13 | 5.8 | COC(=O)C1=C(C)N=C(C)/C(=C(/O)OC(=O)C2=C(C)N=C(C)/C(=C(/O)OC)[C@@H]2c2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc([N+](=O)[O-])c1 | 10.1016/S0960-894X(01)81025-8 | ||
| 44386162 | 60088 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 575 | 11 | 1 | 9 | 6.2 | CC/C=C/COc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175005 | 60088 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 575 | 11 | 1 | 9 | 6.2 | CC/C=C/COc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 44383754 | 59569 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 452 | 5 | 1 | 5 | 5.4 | Cc1ccc(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL172987 | 59569 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 452 | 5 | 1 | 5 | 5.4 | Cc1ccc(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44383742 | 167940 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 452 | 5 | 1 | 5 | 5.4 | Cc1ccc(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL435346 | 167940 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 452 | 5 | 1 | 5 | 5.4 | Cc1ccc(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44339662 | 9759 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 527 | 13 | 1 | 7 | 4.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1nc(C)c(C)o1 | 10.1021/jm980217s | ||
| CHEMBL114074 | 9759 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 527 | 13 | 1 | 7 | 4.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1nc(C)c(C)o1 | 10.1021/jm980217s | ||
| 44385523 | 60738 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 666 | 13 | 2 | 9 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL176418 | 60738 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 666 | 13 | 2 | 9 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 17885918 | 105493 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 458 | 6 | 1 | 6 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccsc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL313044 | 105493 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 458 | 6 | 1 | 6 | 5.9 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccsc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44320431 | 106473 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 526 | 9 | 2 | 7 | 4.9 | O=C(O)COC1CCCCC1Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL314973 | 106473 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 526 | 9 | 2 | 7 | 4.9 | O=C(O)COC1CCCCC1Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| 10723203 | 11345 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 678 | 14 | 2 | 7 | 6.8 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL1180350 | 11345 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 678 | 14 | 2 | 7 | 6.8 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL123206 | 11345 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 678 | 14 | 2 | 7 | 6.8 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| 9961347 | 11857 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL1182945 | 11857 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL273642 | 11857 | 1 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 664 | 13 | 2 | 7 | 6.6 | Cc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCOC(C)C)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| 44320212 | 106517 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 520 | 9 | 2 | 7 | 4.7 | O=C(O)COc1ccccc1Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315280 | 106517 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 520 | 9 | 2 | 7 | 4.7 | O=C(O)COc1ccccc1Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| 10768904 | 12024 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184117 | 12024 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL333034 | 12024 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 10555208 | 12299 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 578 | 9 | 2 | 6 | 5.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1185774 | 12299 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 578 | 9 | 2 | 6 | 5.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL432227 | 12299 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 578 | 9 | 2 | 6 | 5.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2C)cc1 | 10.1021/jm990171i | ||
| 17885921 | 106318 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccn2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL314454 | 106318 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccn2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 155511294 | 169002 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 469 | 6 | 1 | 8 | 2.5 | Cc1ccc(=O)n([C@@H](C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4435789 | 169002 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 469 | 6 | 1 | 8 | 2.5 | Cc1ccc(=O)n([C@@H](C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9985589 | 167680 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 576 | 9 | 1 | 8 | 5.0 | CCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL433700 | 167680 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 576 | 9 | 1 | 8 | 5.0 | CCN(c1ccc2c(c1)oc1c(-c3ccc(OC)cc3)c(C(=O)O)c(=O)n(Cc3ccccc3OC)c12)S(C)(=O)=O | 10.1016/s0960-894x(99)00040-2 | ||
| 44315008 | 102358 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL305524 | 102358 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CCSCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 10792636 | 167950 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(CC)cccc2CC)cc1 | 10.1021/jm990170q | ||
| CHEMBL435385 | 167950 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCOc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(CC)cccc2CC)cc1 | 10.1021/jm990170q | ||
| CHEMBL408437 | 210966 | 0 | None | - | 0 | Bovine | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2c[nH]cn2)C(=O)NCC(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N2CCC[C@@H]2C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/S0960-894X(97)00296-5 | ||||
| 10769177 | 112413 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.2 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CCOC)cc1 | 10.1021/jm990170q | ||
| CHEMBL331066 | 112413 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.2 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CCOC)cc1 | 10.1021/jm990170q | ||
| 11006532 | 12137 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 601 | 10 | 1 | 9 | 6.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3cccs3)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL1184515 | 12137 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 601 | 10 | 1 | 9 | 6.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3cccs3)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL367445 | 12137 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 601 | 10 | 1 | 9 | 6.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3cccs3)cn2)cc1 | 10.1021/jm0102304 | ||
| 10119177 | 116962 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 528 | 12 | 1 | 6 | 4.8 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL339904 | 116962 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 528 | 12 | 1 | 6 | 4.8 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(F)c1 | 10.1021/jm010237l | ||
| 44327890 | 140880 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL384052 | 140880 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL146155 | 207033 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 44333913 | 5032 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 431 | 6 | 1 | 5 | 4.8 | CCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL105591 | 5032 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 431 | 6 | 1 | 5 | 4.8 | CCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44371410 | 49156 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 439 | 5 | 1 | 5 | 5.5 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3C)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL156453 | 49156 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 439 | 5 | 1 | 5 | 5.5 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3C)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 11827657 | 19184 | 1 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 13 | 1 | 7 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(OC)c1 | 10.1021/jm010237l | ||
| CHEMBL129220 | 19184 | 1 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 13 | 1 | 7 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(OC)c1 | 10.1021/jm010237l | ||
| 44279126 | 100260 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 3 | 2 | 3 | 5.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(Cl)cc3Cl)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL29265 | 100260 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 3 | 2 | 3 | 5.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(Cl)cc3Cl)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 44279128 | 106429 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL31469 | 106429 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 428 | 4 | 2 | 4 | 4.2 | COc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@H]32)cc1 | 10.1016/0960-894X(95)00230-Q | ||
| 44279349 | 167584 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 448 | 3 | 2 | 3 | 5.3 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3cccc4ccccc34)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL433039 | 167584 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 448 | 3 | 2 | 3 | 5.3 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3cccc4ccccc34)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 44298393 | 198149 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 432 | 6 | 1 | 6 | 5.2 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2C)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL59425 | 198149 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 432 | 6 | 1 | 6 | 5.2 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2C)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44309996 | 202064 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 483 | 5 | 1 | 8 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccc4nsnc4c3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL67971 | 202064 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 483 | 5 | 1 | 8 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccc4nsnc4c3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| 44387128 | 168024 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 558 | 12 | 2 | 10 | 3.8 | CNCC(=O)OCCOc1nc(C)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL435895 | 168024 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 558 | 12 | 2 | 10 | 3.8 | CNCC(=O)OCCOc1nc(C)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/S0960-894X(97)00400-9 | ||
| 44371571 | 118984 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 425 | 5 | 1 | 5 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL345380 | 118984 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 425 | 5 | 1 | 5 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL414168 | 211368 | 0 | None | - | 0 | Bovine | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL436894 | 211945 | 0 | None | - | 0 | Bovine | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL437610 | 211979 | 0 | None | - | 0 | Bovine | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| 10767505 | 5228 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 494 | 6 | 1 | 8 | 3.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(S(C)(=O)=O)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10661 | 5228 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 494 | 6 | 1 | 8 | 3.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(S(C)(=O)=O)cc2)cc1 | 10.1021/jm9606507 | ||
| 10601191 | 112307 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 492 | 11 | 3 | 6 | 5.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1cc(C(=O)O)[nH]n1 | 10.1021/jm9707131 | ||
| CHEMBL330679 | 112307 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 492 | 11 | 3 | 6 | 5.7 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1-c1cc(C(=O)O)[nH]n1 | 10.1021/jm9707131 | ||
| CHEMBL293874 | 209147 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](C(C)C)NC(=O)CN(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00089a028 | ||||
| 22616255 | 203822 | 11 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 297 | 4 | 1 | 6 | 2.0 | Cc1noc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80945 | 203822 | 11 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 297 | 4 | 1 | 6 | 2.0 | Cc1noc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 345351 | 9269 | 1 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| CHEMBL11131 | 9269 | 1 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.8 | O=C1OC(O)(c2ccccc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| 44298419 | 161450 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 420 | 3 | 1 | 4 | 3.7 | Cc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1I | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL415942 | 161450 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 420 | 3 | 1 | 4 | 3.7 | Cc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1I | 10.1016/s0960-894x(00)00366-8 | ||
| 44386370 | 60094 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 531 | 10 | 4 | 6 | 4.8 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL175066 | 60094 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 531 | 10 | 4 | 6 | 4.8 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL342615 | 209929 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@H](CS(=O)(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 10347080 | 84803 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 535 | 7 | 2 | 8 | 3.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL22562 | 84803 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 535 | 7 | 2 | 8 | 3.0 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| 10576379 | 100801 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL296291 | 100801 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| 10790376 | 166356 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 466 | 6 | 1 | 6 | 3.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N2CCCCC2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL428644 | 166356 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 466 | 6 | 1 | 6 | 3.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N2CCCCC2)cc1 | 10.1021/jm9505369 | ||
| 11827489 | 116485 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 524 | 12 | 1 | 4 | 5.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL338754 | 116485 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 524 | 12 | 1 | 4 | 5.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)c(F)c1 | 10.1021/jm010237l | ||
| 9916121 | 81255 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 571 | 10 | 1 | 8 | 4.1 | CCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2163693 | 81255 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 571 | 10 | 1 | 8 | 4.1 | CCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 10792319 | 205504 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 530 | 10 | 1 | 6 | 5.1 | CCCCN(C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm9505369 | ||
| CHEMBL9283 | 205504 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 530 | 10 | 1 | 6 | 5.1 | CCCCN(C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm9505369 | ||
| 44265869 | 96813 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 7 | 2 | 6 | 3.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC2CCCC2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL268864 | 96813 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 7 | 2 | 6 | 3.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC2CCCC2)cc1 | 10.1021/jm9505369 | ||
| 23445457 | 128502 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 5.1 | Cc1cc(C)c(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL367024 | 128502 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 5.1 | Cc1cc(C)c(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| 10962637 | 9984 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 549 | 10 | 2 | 9 | 4.3 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(CO)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL115372 | 9984 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 549 | 10 | 2 | 9 | 4.3 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(CO)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL1627023 | 9984 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 549 | 10 | 2 | 9 | 4.3 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(CO)cn2)cc1 | 10.1021/jm000538f | ||
| 10531506 | 12010 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2cc(C)ccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184076 | 12010 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2cc(C)ccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL331548 | 12010 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 592 | 9 | 2 | 6 | 5.8 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2cc(C)ccc2C)cc1 | 10.1021/jm990171i | ||
| CHEMBL2304013 | 207724 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC(C)[C@H]1NC(=O)[C@H](C(C)(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC1=O | 10.1021/jm9600914 | ||||
| 44320474 | 106585 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 8 | 1 | 5 | 5.7 | CCC(CC)Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315752 | 106585 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 8 | 1 | 5 | 5.7 | CCC(CC)Cn1nc(-c2ccccc2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm0102304 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm0102304 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm0102304 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm0102304 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm0102304 | ||
| 44298330 | 101078 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 518 | 10 | 1 | 8 | 5.4 | COC(=O)CCCc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Sc1cccc(OC)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL298340 | 101078 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 518 | 10 | 1 | 8 | 5.4 | COC(=O)CCCc1onc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Sc1cccc(OC)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44458650 | 84479 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 521 | 7 | 2 | 8 | 2.7 | COc1ccccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL22367 | 84479 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 521 | 7 | 2 | 8 | 2.7 | COc1ccccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| 155544917 | 172842 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 13 | 2 | 10 | 3.4 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2cc(OC)ccc2Cl)c1-c1ncc(SC)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4528516 | 172842 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 13 | 2 | 10 | 3.4 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2cc(OC)ccc2Cl)c1-c1ncc(SC)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 11732155 | 200979 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1ccccc1C1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL61460 | 200979 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 402 | 4 | 1 | 5 | 4.4 | COc1ccccc1C1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| 10672060 | 9170 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 470 | 10 | 1 | 6 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)c(OC)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL110794 | 9170 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 470 | 10 | 1 | 6 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)c(OC)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 19385674 | 98137 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 715 | 13 | 1 | 7 | 8.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1cc(Br)c(OC)c(OC)c1Br | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL276819 | 98137 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 715 | 13 | 1 | 7 | 8.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1cc(Br)c(OC)c(OC)c1Br | 10.1016/0960-894X(95)00186-W | ||
| 19385674 | 98137 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 715 | 13 | 1 | 7 | 8.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1cc(Br)c(OC)c(OC)c1Br | 10.1021/jm058225d | ||
| CHEMBL276819 | 98137 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 715 | 13 | 1 | 7 | 8.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)O)c1cc(Br)c(OC)c(OC)c1Br | 10.1021/jm058225d | ||
| 52943105 | 18293 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 9 | 2 | 7 | 4.7 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1272190 | 18293 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 9 | 2 | 7 | 4.7 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 52943105 | 18293 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 9 | 2 | 7 | 4.7 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1272190 | 18293 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 9 | 2 | 7 | 4.7 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10744973 | 205545 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 538 | 14 | 1 | 6 | 5.5 | CCCCCN(CCCCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9313 | 205545 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 538 | 14 | 1 | 6 | 5.5 | CCCCCN(CCCCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 155517241 | 169591 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 522 | 14 | 2 | 11 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4444355 | 169591 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 522 | 14 | 2 | 11 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 44265870 | 205837 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 5.1 | CCCCN(CCCC)C(=O)C(C)N1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9488 | 205837 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 5.1 | CCCCN(CCCC)C(=O)C(C)N1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44384715 | 60043 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 559 | 9 | 1 | 9 | 5.2 | CC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL174607 | 60043 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 559 | 9 | 1 | 9 | 5.2 | CC#CCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10305334 | 128525 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 680 | 12 | 2 | 11 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367036 | 128525 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 680 | 12 | 2 | 11 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10671928 | 7195 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 467 | 5 | 1 | 7 | 4.4 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2nccc3ccccc23)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10860 | 7195 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 467 | 5 | 1 | 7 | 4.4 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2nccc3ccccc23)cc1 | 10.1021/jm9606507 | ||
| 44295089 | 14463 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 476 | 8 | 1 | 7 | 5.4 | COc1ccc(C(=O)/C(Cc2ccc(SC)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205088 | 14463 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 476 | 8 | 1 | 7 | 5.4 | COc1ccc(C(=O)/C(Cc2ccc(SC)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL51030 | 14463 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 476 | 8 | 1 | 7 | 5.4 | COc1ccc(C(=O)/C(Cc2ccc(SC)cc2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 15340613 | 106361 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 414 | 6 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(-c3ccccc3)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144732 | 106361 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 414 | 6 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(-c3ccccc3)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10837666 | 169321 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 460 | 8 | 1 | 4 | 4.6 | CCCN(C)C(=O)CN1C[C@H](c2cccc3ccccc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL444061 | 169321 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 460 | 8 | 1 | 4 | 4.6 | CCCN(C)C(=O)CN1C[C@H](c2cccc3ccccc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 9870959 | 8829 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| CHEMBL109778 | 8829 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 509 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccccn1 | 10.1021/jm980217s | ||
| 71451529 | 81281 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 632 | 14 | 2 | 12 | 3.4 | CCCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163719 | 81281 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 632 | 14 | 2 | 12 | 3.4 | CCCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 18184228 | 61024 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 604 | 13 | 2 | 9 | 4.6 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL176749 | 61024 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 604 | 13 | 2 | 9 | 4.6 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 44384651 | 127977 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 498 | 6 | 2 | 8 | 4.0 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2cc3c(cc2CO)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL366680 | 127977 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 498 | 6 | 2 | 8 | 4.0 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2cc3c(cc2CO)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 10696210 | 99087 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 483 | 6 | 2 | 9 | 3.7 | CC(=O)c1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| CHEMBL283535 | 99087 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 483 | 6 | 2 | 9 | 3.7 | CC(=O)c1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| 44291884 | 172329 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 483 | 6 | 2 | 9 | 3.7 | CC(=O)c1c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)ccc2c1OCO2 | 10.1021/jm9700068 | ||
| CHEMBL45160 | 172329 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 483 | 6 | 2 | 9 | 3.7 | CC(=O)c1c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)ccc2c1OCO2 | 10.1021/jm9700068 | ||
| 11795139 | 165984 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 6 | 2 | 6 | 1.8 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(N)=O)cc1 | 10.1021/jm9505369 | ||
| CHEMBL427935 | 165984 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 6 | 2 | 6 | 1.8 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(N)=O)cc1 | 10.1021/jm9505369 | ||
| 23445516 | 106146 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 7 | 1 | 5 | 5.9 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(CCC(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL314307 | 106146 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 7 | 1 | 5 | 5.9 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(CCC(C)C)cc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 44384757 | 165595 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 482 | 5 | 1 | 7 | 4.8 | Cc1cc2c(cc1/C=C/c1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL426218 | 165595 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 482 | 5 | 1 | 7 | 4.8 | Cc1cc2c(cc1/C=C/c1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL216082 | 207572 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| CHEMBL2370255 | 208074 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 9830495 | 130627 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 14 | 2 | 9 | 5.0 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368617 | 130627 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 618 | 14 | 2 | 9 | 5.0 | CCS(=O)(=O)NCCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL94907 | 214137 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 11505449 | 170918 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 616 | 12 | 3 | 9 | 2.6 | O=C(O)CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4463633 | 170918 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 616 | 12 | 3 | 9 | 2.6 | O=C(O)CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44309814 | 102532 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 487 | 8 | 1 | 7 | 6.2 | CCCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)n2Cc1cc2nsnc2cc1C | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL306863 | 102532 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 487 | 8 | 1 | 7 | 6.2 | CCCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)n2Cc1cc2nsnc2cc1C | 10.1016/s0960-894x(97)10151-2 | ||
| 9909467 | 203800 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 409 | 4 | 1 | 5 | 3.8 | Cc1noc(NS(=O)(=O)c2cccc3c(N(C)C)cccc23)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80782 | 203800 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 409 | 4 | 1 | 5 | 3.8 | Cc1noc(NS(=O)(=O)c2cccc3c(N(C)C)cccc23)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL86814 | 214115 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | 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](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 44213279 | 106365 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 456 | 6 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144737 | 106365 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 456 | 6 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL86814 | 214115 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | 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](Cc1ccccc1)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/jm00095a029 | ||||
| 44266549 | 161817 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 415 | 4 | 1 | 6 | 4.5 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL416518 | 161817 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 415 | 4 | 1 | 6 | 4.5 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 44316458 | 203730 | 2 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 408 | 3 | 1 | 4 | 3.6 | Cc1noc(NS(=O)(=O)c2cc(Br)ccc2Br)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80317 | 203730 | 2 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 408 | 3 | 1 | 4 | 3.6 | Cc1noc(NS(=O)(=O)c2cc(Br)ccc2Br)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 44277034 | 106360 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1ccccc1Cn1[nH]c(C(F)(F)F)c(Cc2ccc3c(c2)OCO3)c1=O | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144729 | 106360 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1ccccc1Cn1[nH]c(C(F)(F)F)c(Cc2ccc3c(c2)OCO3)c1=O | 10.1016/s0960-894x(00)00232-8 | ||
| 10576910 | 108052 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 486 | 13 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC=C(C)C | 10.1021/jm980217s | ||
| CHEMBL320124 | 108052 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 486 | 13 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC=C(C)C | 10.1021/jm980217s | ||
| 44384826 | 59661 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 561 | 10 | 1 | 9 | 5.8 | C/C=C/COc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173366 | 59661 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 561 | 10 | 1 | 9 | 5.8 | C/C=C/COc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 22998456 | 59482 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 514 | 8 | 1 | 8 | 4.9 | CCCc1cc2c(cc1OCc1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL172666 | 59482 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 514 | 8 | 1 | 8 | 4.9 | CCCc1cc2c(cc1OCc1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00132-7 | ||
| 10694547 | 205346 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 443 | 10 | 1 | 7 | 2.9 | COCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9183 | 205346 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 443 | 10 | 1 | 7 | 2.9 | COCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10507467 | 8415 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 580 | 12 | 1 | 7 | 4.5 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)Cc1ccccc1 | 10.1021/jm970101g | ||
| CHEMBL109408 | 8415 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 580 | 12 | 1 | 7 | 4.5 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)Cc1ccccc1 | 10.1021/jm970101g | ||
| 44314660 | 103886 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 633 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCC1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL310111 | 103886 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 633 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1CCCCC1C)C(=O)O | 10.1021/jm9600914 | ||
| 22467235 | 96078 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 533 | 7 | 2 | 7 | 3.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL262784 | 96078 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 533 | 7 | 2 | 7 | 3.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 10050696 | 96330 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.3 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL26474 | 96330 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.3 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 10050696 | 96330 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.3 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL26474 | 96330 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.3 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 73669992 | 117128 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 387 | 9 | 1 | 4 | 5.4 | N#CCCC(Oc1cc(OCc2ccccc2)ccc1C(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL3400998 | 117128 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 387 | 9 | 1 | 4 | 5.4 | N#CCCC(Oc1cc(OCc2ccccc2)ccc1C(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| 23670447 | 2980 | 2 | None | - | 2 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1016/s0960-894x(98)00301-1 | ||
| 999 | 2980 | 2 | None | - | 2 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1204799 | 2980 | 2 | None | - | 2 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL25438 | 2980 | 2 | None | - | 2 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1016/s0960-894x(98)00301-1 | ||
| 10311570 | 14461 | 0 | None | - | 1 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205068 | 14461 | 0 | None | - | 1 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL48907 | 14461 | 0 | None | - | 1 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2cc(OC)c(OC)c(OC)c2)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44295206 | 14624 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 580 | 12 | 1 | 11 | 4.7 | COc1cc(C/C(C(=O)c2cc(OC)c(OC)c(OC)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206728 | 14624 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 580 | 12 | 1 | 11 | 4.7 | COc1cc(C/C(C(=O)c2cc(OC)c(OC)c(OC)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL301577 | 14624 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 580 | 12 | 1 | 11 | 4.7 | COc1cc(C/C(C(=O)c2cc(OC)c(OC)c(OC)c2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| 9871348 | 202329 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 8 | 1 | 10 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4nsnc4c3)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL69741 | 202329 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 520 | 8 | 1 | 10 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc4nsnc4c3)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| 18617366 | 167273 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2ccc(Br)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL430822 | 167273 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2ccc(Br)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 11102609 | 168005 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 6 | 1 | 6 | 5.2 | COc1ccc([C@@H]2c3cc(OC(C)C)ccc3O[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1021/jm010382z | ||
| CHEMBL435773 | 168005 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 462 | 6 | 1 | 6 | 5.2 | COc1ccc([C@@H]2c3cc(OC(C)C)ccc3O[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1021/jm010382z | ||
| 10790183 | 204522 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 461 | 8 | 1 | 6 | 4.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCOc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8677 | 204522 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 461 | 8 | 1 | 6 | 4.3 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCOc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| 10673715 | 9460 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 528 | 14 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCCC(F)(F)F | 10.1021/jm980217s | ||
| CHEMBL112314 | 9460 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 528 | 14 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCCC(F)(F)F | 10.1021/jm980217s | ||
| 10789715 | 112599 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 450 | 8 | 1 | 5 | 4.2 | CCCN(C)C(=O)CN1C[C@H](c2cccc3occc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL331375 | 112599 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 450 | 8 | 1 | 5 | 4.2 | CCCN(C)C(=O)CN1C[C@H](c2cccc3occc23)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL2369711 | 207909 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 10697633 | 60015 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 10 | 5 | 5 | 4.4 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL174448 | 60015 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 10 | 5 | 5 | 4.4 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10415348 | 60762 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 557 | 9 | 3 | 6 | 4.8 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL176514 | 60762 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 557 | 9 | 3 | 6 | 4.8 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10697633 | 60015 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 10 | 5 | 5 | 4.4 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL174448 | 60015 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 536 | 10 | 5 | 5 | 4.4 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 71456862 | 81271 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 651 | 12 | 1 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163709 | 81271 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 651 | 12 | 1 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 10274552 | 73166 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 6 | 1 | 8 | 3.6 | Cc1cc2c(cc1CC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1C)OCO2 | 10.1021/jm9700068 | ||
| CHEMBL20168 | 73166 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 6 | 1 | 8 | 3.6 | Cc1cc2c(cc1CC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1C)OCO2 | 10.1021/jm9700068 | ||
| 9807200 | 84921 | 0 | None | -346 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261359 | 84921 | 0 | None | -346 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| 71458720 | 81272 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 665 | 13 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)Cc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163710 | 81272 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 665 | 13 | 1 | 12 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)Cc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 23445533 | 60091 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.0 | Cc1ccc(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL175045 | 60091 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.0 | Cc1ccc(CCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 10896412 | 201116 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1OC)O2 | 10.1021/jm010382z | ||
| CHEMBL62277 | 201116 | 0 | None | - | 0 | Pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1OC)O2 | 10.1021/jm010382z | ||
| CHEMBL327350 | 209544 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 44327585 | 161234 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 992 | 26 | 9 | 8 | 5.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL414082 | 161234 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 992 | 26 | 9 | 8 | 5.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1CCCCC1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 44368824 | 96379 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 1595 | 31 | 19 | 20 | 0.6 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| 77282142 | 96379 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 1595 | 31 | 19 | 20 | 0.6 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| CHEMBL265164 | 96379 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 1595 | 31 | 19 | 20 | 0.6 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||
| 10982740 | 201692 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 5 | 1 | 5 | 5.4 | CC(C)Oc1ccc2c(c1)C(C1CCCC1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL65353 | 201692 | 0 | None | - | 0 | Pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 5 | 1 | 5 | 5.4 | CC(C)Oc1ccc2c(c1)C(C1CCCC1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 44371429 | 48636 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1cccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL155973 | 48636 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 455 | 6 | 1 | 6 | 5.2 | COc1cccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| 11762291 | 100169 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccccc1C1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL292041 | 100169 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1ccccc1C1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 9807178 | 201302 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 384 | 5 | 1 | 6 | 3.8 | COC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL63121 | 201302 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 384 | 5 | 1 | 6 | 3.8 | COC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 10648006 | 161117 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 4.7 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL413093 | 161117 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 468 | 6 | 1 | 6 | 4.7 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL438194 | 212005 | 7 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | 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](Cc1ccc(-c2ccccc2)cc1)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/jm00095a029 | ||||
| 9848132 | 205843 | 0 | None | - | 2 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94918 | 205843 | 0 | None | - | 2 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44368417 | 44397 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 504 | 12 | 2 | 6 | 4.9 | COc1ccc(CN(Cc2cc(OC)c(OC)c(OC)c2)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152065 | 44397 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 504 | 12 | 2 | 6 | 4.9 | COc1ccc(CN(Cc2cc(OC)c(OC)c(OC)c2)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 18617302 | 103937 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 334 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccccc2F)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL310361 | 103937 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 334 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2ccccc2F)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44298394 | 162485 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 340 | 4 | 1 | 5 | 3.8 | CSc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)noc1C | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL417595 | 162485 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 340 | 4 | 1 | 5 | 3.8 | CSc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)noc1C | 10.1016/s0960-894x(00)00366-8 | ||
| 10575356 | 9617 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 446 | 8 | 1 | 4 | 3.7 | CCCN(C)C(=O)CN1C[C@H](c2ccc(F)c(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL113184 | 9617 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 446 | 8 | 1 | 4 | 3.7 | CCCN(C)C(=O)CN1C[C@H](c2ccc(F)c(F)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10298764 | 9761 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.2 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL114084 | 9761 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 468 | 8 | 1 | 6 | 3.2 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10647182 | 109234 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 449 | 8 | 2 | 4 | 3.9 | CCCN(C)C(=O)CN1C[C@H](c2ccc3cc[nH]c3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL322935 | 109234 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 449 | 8 | 2 | 4 | 3.9 | CCCN(C)C(=O)CN1C[C@H](c2ccc3cc[nH]c3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10765567 | 110866 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2cccc(OC)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL326951 | 110866 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2cccc(OC)c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10415822 | 129297 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 579 | 9 | 3 | 7 | 4.7 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCOC23CCCCC3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL367551 | 129297 | 0 | None | - | 0 | Pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 579 | 9 | 3 | 7 | 4.7 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCOC23CCCCC3)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44384610 | 127949 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 743 | 16 | 2 | 14 | 4.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL366627 | 127949 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 743 | 16 | 2 | 14 | 4.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10813822 | 96522 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 460 | 5 | 2 | 5 | 4.5 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)Nc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266336 | 96522 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 460 | 5 | 2 | 5 | 4.5 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)Nc2ccccc2)cc1 | 10.1021/jm9505369 | ||
| 22998447 | 204948 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 414 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2sccc2Oc2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL89457 | 204948 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 414 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2sccc2Oc2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 10226215 | 100962 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 455 | 5 | 2 | 8 | 3.8 | Cc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| CHEMBL297473 | 100962 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 455 | 5 | 2 | 8 | 3.8 | Cc1cc2c(cc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl)OCO2 | 10.1021/jm9608366 | ||
| 10648715 | 109181 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCC(C)C | 10.1021/jm980217s | ||
| CHEMBL322547 | 109181 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCC(C)C | 10.1021/jm980217s | ||
| 10598270 | 96496 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 421 | 6 | 1 | 5 | 4.1 | CCCC#CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266144 | 96496 | 0 | None | - | 0 | Pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 421 | 6 | 1 | 5 | 4.1 | CCCC#CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10302092 | 110849 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 532 | 12 | 1 | 7 | 3.7 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCC | 10.1021/jm970101g | ||
| CHEMBL326861 | 110849 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 532 | 12 | 1 | 7 | 3.7 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCC | 10.1021/jm970101g | ||
| CHEMBL267754 | 208985 | 0 | None | - | 0 | Bovine | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| CHEMBL327350 | 209544 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| 10907399 | 201267 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 516 | 11 | 1 | 6 | 6.8 | CCCCOc1ccc(C2Oc3ccc(OCCCC)cc3C(c3ccc4c(c3)OCO4)=C2C(=O)O)cc1 | 10.1021/jm010382z | ||
| CHEMBL62976 | 201267 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 516 | 11 | 1 | 6 | 6.8 | CCCCOc1ccc(C2Oc3ccc(OCCCC)cc3C(c3ccc4c(c3)OCO4)=C2C(=O)O)cc1 | 10.1021/jm010382z | ||
| 10577405 | 9561 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1C(C)(C)CCCC | 10.1021/jm980217s | ||
| CHEMBL112777 | 9561 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1C(C)(C)CCCC | 10.1021/jm980217s | ||
| 10767280 | 108181 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 486 | 14 | 1 | 5 | 5.1 | C=C(C)CCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL320763 | 108181 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 486 | 14 | 1 | 5 | 5.1 | C=C(C)CCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 44277367 | 106355 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 392 | 4 | 2 | 5 | 3.3 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1cccc(O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144606 | 106355 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 392 | 4 | 2 | 5 | 3.3 | O=c1c(Cc2ccc3c(c2)OCO3)c(C(F)(F)F)[nH]n1Cc1cccc(O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10168195 | 61058 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 631 | 11 | 2 | 13 | 5.0 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176999 | 61058 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 631 | 11 | 2 | 13 | 5.0 | C#CCOc1nc(-c2ccnc(-c3noc(S)n3)c2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 18184179 | 128500 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 654 | 13 | 2 | 12 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367017 | 128500 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 654 | 13 | 2 | 12 | 4.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(-c2ccncc2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL421190 | 211521 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)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/jm00015a003 | ||||
| CHEMBL94525 | 214134 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 18617322 | 203749 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2ccccc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80438 | 203749 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2ccccc2Cl)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44385593 | 128952 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 530 | 10 | 5 | 5 | 4.5 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL367208 | 128952 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 530 | 10 | 5 | 5 | 4.5 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10839533 | 100975 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 513 | 5 | 2 | 9 | 2.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)NC(=O)c2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL297599 | 100975 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 513 | 5 | 2 | 9 | 2.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)NC(=O)c2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 10742446 | 205284 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 9 | 2 | 7 | 2.0 | COCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9147 | 205284 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 9 | 2 | 7 | 2.0 | COCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 71460535 | 81273 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 693 | 15 | 1 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163711 | 81273 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 693 | 15 | 1 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)CCCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 10624915 | 204510 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 490 | 6 | 2 | 6 | 4.5 | COc1ccc(NC(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)O)[C@H]2c2ccc(OC)cc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8671 | 204510 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 490 | 6 | 2 | 6 | 4.5 | COc1ccc(NC(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)O)[C@H]2c2ccc(OC)cc2)cc1 | 10.1021/jm9505369 | ||
| 9938571 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL112531 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL369489 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| 9938571 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL112531 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL369489 | 9506 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm0102304 | ||
| 9807691 | 99602 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL287169 | 99602 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 553 | 10 | 1 | 10 | 5.3 | COc1cc2c(Sc3cc(OC)c(OC)c(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 18617344 | 203567 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 361 | 4 | 1 | 6 | 2.5 | Cc1noc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL79080 | 203567 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 361 | 4 | 1 | 6 | 2.5 | Cc1noc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 18617395 | 203561 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 361 | 4 | 1 | 6 | 2.5 | Cc1noc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL79030 | 203561 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 361 | 4 | 1 | 6 | 2.5 | Cc1noc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10789279 | 204839 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 441 | 10 | 1 | 6 | 4.1 | CCCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8878 | 204839 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 441 | 10 | 1 | 6 | 4.1 | CCCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44327347 | 96315 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL264579 | 96315 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 10765171 | 7813 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc(OC)c(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10901 | 7813 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3ccc(OC)c(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 10503921 | 101006 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | Cc1cc2c(cc1CC(=O)c1sccc1S(=O)(=O)Nc1noc(C)c1Cl)OCO2 | 10.1021/jm9700068 | ||
| CHEMBL297783 | 101006 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | Cc1cc2c(cc1CC(=O)c1sccc1S(=O)(=O)Nc1noc(C)c1Cl)OCO2 | 10.1021/jm9700068 | ||
| 18617318 | 105134 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2ccccc2Br)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL312266 | 105134 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2ccccc2Br)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44277245 | 106364 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 392 | 6 | 1 | 4 | 3.9 | COc1ccc(Cc2c(C(F)(F)F)[nH]n(Cc3cccc(OC)c3)c2=O)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144736 | 106364 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 392 | 6 | 1 | 4 | 3.9 | COc1ccc(Cc2c(C(F)(F)F)[nH]n(Cc3cccc(OC)c3)c2=O)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| 16004692 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 4809 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 7352 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2103873 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| DB08932 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 16004692 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1021/jm3009103 | ||
| 4809 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1021/jm3009103 | ||
| 7352 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1021/jm3009103 | ||
| CHEMBL2103873 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1021/jm3009103 | ||
| DB08932 | 2421 | 85 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1021/jm3009103 | ||
| 9915510 | 84731 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 549 | 8 | 2 | 8 | 3.4 | CCOc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL22513 | 84731 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 549 | 8 | 2 | 8 | 3.4 | CCOc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1016/s0960-894x(01)00660-6 | ||
| 9915510 | 84731 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 549 | 8 | 2 | 8 | 3.4 | CCOc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL22513 | 84731 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 549 | 8 | 2 | 8 | 3.4 | CCOc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(N)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| 9873255 | 59322 | 0 | None | - | 2 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 591 | 14 | 2 | 10 | 3.8 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172071 | 59322 | 0 | None | - | 2 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 591 | 14 | 2 | 10 | 3.8 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 10719598 | 205262 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9139 | 205262 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44339655 | 9018 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 530 | 14 | 1 | 6 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2cc(OC)c3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL109926 | 9018 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 530 | 14 | 1 | 6 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2cc(OC)c3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 23445254 | 205426 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 412 | 5 | 1 | 5 | 4.2 | Cc1noc(NS(=O)(=O)c2sccc2Cc2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL92318 | 205426 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 412 | 5 | 1 | 5 | 4.2 | Cc1noc(NS(=O)(=O)c2sccc2Cc2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 10599230 | 205267 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 440 | 8 | 2 | 6 | 2.8 | CCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9141 | 205267 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 440 | 8 | 2 | 6 | 2.8 | CCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44314904 | 102672 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 585 | 12 | 5 | 5 | 3.6 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL307936 | 102672 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 585 | 12 | 5 | 5 | 3.6 | CSCCC(NC(=O)[C@@H](Cc1c(C)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C1CC1)C(=O)O | 10.1021/jm9600914 | ||
| 10529868 | 163639 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 516 | 8 | 2 | 6 | 4.8 | CCc1cccc(C)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL421073 | 163639 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 516 | 8 | 2 | 6 | 4.8 | CCc1cccc(C)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 9917706 | 129217 | 0 | None | - | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL367444 | 129217 | 0 | None | - | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44320777 | 204483 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 550 | 10 | 2 | 8 | 4.7 | COc1ccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL86505 | 204483 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 550 | 10 | 2 | 8 | 4.7 | COc1ccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 9897092 | 59621 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 779 | 17 | 2 | 13 | 6.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL173201 | 59621 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 779 | 17 | 2 | 13 | 6.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9810400 | 98155 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 710 | 14 | 2 | 12 | 5.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL276949 | 98155 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 710 | 14 | 2 | 12 | 5.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 9917706 | 129217 | 0 | None | - | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367444 | 129217 | 0 | None | - | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 659 | 15 | 2 | 11 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10209779 | 162879 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 560 | 14 | 1 | 7 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL419749 | 162879 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 560 | 14 | 1 | 7 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 44314659 | 203410 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | C=CCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL77853 | 203410 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 631 | 12 | 5 | 4 | 4.5 | C=CCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 9894460 | 204982 | 6 | None | -41 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm970101g | ||
| CHEMBL313871 | 204982 | 6 | None | -41 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm970101g | ||
| CHEMBL8978 | 204982 | 6 | None | -41 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm970101g | ||
| 10303555 | 162829 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 574 | 15 | 1 | 7 | 4.9 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL419383 | 162829 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 574 | 15 | 1 | 7 | 4.9 | CCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 1009 | 192 | 20 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| 5310991 | 192 | 20 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| CHEMBL332794 | 192 | 20 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | nan | ||
| 44315009 | 102731 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CSCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL308403 | 102731 | 0 | None | - | 0 | Pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 665 | 13 | 5 | 5 | 4.7 | CSCCC(NC(=O)[C@@H](Cc1c(Br)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44314675 | 97676 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)CC)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL273583 | 97676 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)CC)C(=O)O | 10.1021/jm9600914 | ||
| 44314676 | 102451 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 589 | 12 | 5 | 4 | 4.6 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL306171 | 102451 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 589 | 12 | 5 | 4 | 4.6 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| 17885919 | 204684 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 526 | 9 | 2 | 8 | 4.8 | O=C(O)COc1ccccc1Cn1nc(-c2cccs2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL87801 | 204684 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 526 | 9 | 2 | 8 | 4.8 | O=C(O)COc1ccccc1Cn1nc(-c2cccs2)c(Cc2cc3c(cc2Cl)OCO3)c1C(=O)O | 10.1016/s0960-894x(00)00513-8 | ||
| 44320171 | 106474 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 504 | 6 | 1 | 5 | 6.4 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC12CC3CC(CC(C3)C1)C2 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL314974 | 106474 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 504 | 6 | 1 | 5 | 6.4 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC12CC3CC(CC(C3)C1)C2 | 10.1016/s0960-894x(00)00513-8 | ||
| 10252787 | 98809 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 442 | 7 | 1 | 6 | 4.6 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3ccc4c(c3)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL281865 | 98809 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 442 | 7 | 1 | 6 | 4.6 | COc1cccc(Cn2nc(-c3ccccc3)c(Cc3ccc4c(c3)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL1790519 | 207150 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | 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](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N(C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@H](C)CC | 10.1021/jm970161m | ||||
| 10648937 | 205575 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9334 | 205575 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44327466 | 96004 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 966 | 25 | 9 | 8 | 5.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL262229 | 96004 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 966 | 25 | 9 | 8 | 5.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 11103152 | 162689 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)c(OC)c1)O2 | 10.1021/jm010382z | ||
| CHEMBL418473 | 162689 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 504 | 9 | 1 | 7 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)c(OC)c1)O2 | 10.1021/jm010382z | ||
| 10364227 | 201111 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL62264 | 201111 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 11059349 | 201815 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 446 | 6 | 1 | 6 | 4.8 | CCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL66264 | 201815 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 446 | 6 | 1 | 6 | 4.8 | CCOc1ccc2c(c1)C(c1ccc(OC)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 44298279 | 193282 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 502 | 10 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(C)=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54274 | 193282 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 502 | 10 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(C)=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 10239569 | 14619 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 534 | 9 | 1 | 10 | 4.4 | COc1cc(C/C(C(=O)c2ccc3c(c2)OCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1206715 | 14619 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 534 | 9 | 1 | 10 | 4.4 | COc1cc(C/C(C(=O)c2ccc3c(c2)OCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL299328 | 14619 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 534 | 9 | 1 | 10 | 4.4 | COc1cc(C/C(C(=O)c2ccc3c(c2)OCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| 10364227 | 201111 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm031041j | ||
| CHEMBL62264 | 201111 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)[C@@H](c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm031041j | ||
| 18617355 | 203246 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1ccc(S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76438 | 203246 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1ccc(S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/0960-894X(96)00441-6 | ||
| 11026419 | 201492 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3c(OC)cccc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64266 | 201492 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3c(OC)cccc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL2370070 | 208034 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| CHEMBL315047 | 209440 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | 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](Cc1ccc2ccccc2c1)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/jm00095a029 | ||||
| 10718385 | 205084 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 450 | 7 | 1 | 6 | 2.4 | C#CCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9040 | 205084 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 450 | 7 | 1 | 6 | 2.4 | C#CCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10550844 | 96860 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 435 | 5 | 1 | 6 | 3.7 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)c2ccco2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL269140 | 96860 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 435 | 5 | 1 | 6 | 3.7 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)c2ccco2)cc1 | 10.1021/jm9505369 | ||
| 10553316 | 96629 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL267279 | 96629 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10205245 | 71865 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 466 | 5 | 2 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2C#N)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL19808 | 71865 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 466 | 5 | 2 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2C#N)OCO3)c1Cl | 10.1021/jm9608366 | ||
| 44291575 | 178855 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 466 | 5 | 2 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2C#N)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL47404 | 178855 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 466 | 5 | 2 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc3c(c2C#N)OCO3)c1Cl | 10.1021/jm9700068 | ||
| 137642741 | 157694 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 553 | 9 | 2 | 9 | 4.2 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4088349 | 157694 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 553 | 9 | 2 | 9 | 4.2 | CCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10005597 | 119313 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cc(OC)ccc3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL348407 | 119313 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cc(OC)ccc3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 10531650 | 167698 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 600 | 11 | 1 | 7 | 5.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm970101g | ||
| CHEMBL433842 | 167698 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 600 | 11 | 1 | 7 | 5.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm970101g | ||
| 9852318 | 9523 | 5 | None | - | 2 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL112624 | 9523 | 5 | None | - | 2 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL1627022 | 9523 | 5 | None | - | 2 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10578320 | 96861 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 538 | 12 | 1 | 6 | 5.2 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(CCC(C)C)CCC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL269141 | 96861 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 538 | 12 | 1 | 6 | 5.2 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(CCC(C)C)CCC(C)C)cc1 | 10.1021/jm9505369 | ||
| 10917653 | 201686 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 468 | 11 | 1 | 6 | 6.1 | CCCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL65292 | 201686 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 468 | 11 | 1 | 6 | 6.1 | CCCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 9821701 | 4544 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 4 | 1 | 5 | 3.8 | COc1ccc([C@@H]2c3ncccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102825 | 4544 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 4 | 1 | 5 | 3.8 | COc1ccc([C@@H]2c3ncccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 10767586 | 9677 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 13 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(OC)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL113529 | 9677 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 13 | 1 | 5 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(OC)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10602183 | 9149 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 525 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1ccccc1=O | 10.1021/jm980217s | ||
| CHEMBL110695 | 9149 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 525 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1ccccc1=O | 10.1021/jm980217s | ||
| 44383537 | 58937 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 388 | 4 | 2 | 5 | 3.4 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| CHEMBL170335 | 58937 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 388 | 4 | 2 | 5 | 3.4 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| 23445430 | 60740 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.1 | Cc1ccc(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL176422 | 60740 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.1 | Cc1ccc(/C=C/c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44384652 | 60956 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 582 | 8 | 1 | 9 | 5.2 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2cc3c(cc2COC2CCOCC2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL176675 | 60956 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 582 | 8 | 1 | 9 | 5.2 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2cc3c(cc2COC2CCOCC2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 155519384 | 169850 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 674 | 12 | 1 | 13 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)c1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4448273 | 169850 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 674 | 12 | 1 | 13 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)c1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 71458719 | 81266 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 647 | 15 | 1 | 13 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(SC)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163704 | 81266 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 647 | 15 | 1 | 13 | 4.7 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(SC)cn1 | 10.1021/jm3009103 | ||
| 10146640 | 205820 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 689 | 12 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL94786 | 205820 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 689 | 12 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccn1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10366278 | 171897 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 446 | 6 | 2 | 6 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL448165 | 171897 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 446 | 6 | 2 | 6 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44278215 | 99097 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 491 | 5 | 1 | 9 | 4.7 | O=C(O)c1c(Sc2ccc3c(c2)OCO3)c2cc3c(cc2n1Cc1ccc2c(c1)OCO2)OCO3 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL283598 | 99097 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 491 | 5 | 1 | 9 | 4.7 | O=C(O)c1c(Sc2ccc3c(c2)OCO3)c2cc3c(cc2n1Cc1ccc2c(c1)OCO2)OCO3 | 10.1016/0960-894X(96)00232-6 | ||
| 18995986 | 99120 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL283858 | 99120 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 537 | 8 | 1 | 10 | 5.0 | COc1ccc(Sc2c(C(=O)O)n(Cc3cc(OC)c4c(c3)OCO4)c3cc4c(cc23)OCO4)cc1OC | 10.1016/0960-894X(96)00232-6 | ||
| 44270522 | 45548 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 744 | 15 | 1 | 10 | 8.2 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccc(CC(C)C)s1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL15310 | 45548 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 744 | 15 | 1 | 10 | 8.2 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccc(CC(C)C)s1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 44284183 | 139045 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 518 | 9 | 2 | 7 | 5.7 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OCC(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL37973 | 139045 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 518 | 9 | 2 | 7 | 5.7 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OCC(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 44386069 | 59423 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 704 | 13 | 2 | 11 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172441 | 59423 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 704 | 13 | 2 | 11 | 5.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44291495 | 11129 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 455 | 6 | 2 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2/C(Cc2ccc3c(c2)OCO3)=N\O)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL1178832 | 11129 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 455 | 6 | 2 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2/C(Cc2ccc3c(c2)OCO3)=N\O)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL45351 | 11129 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 455 | 6 | 2 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2/C(Cc2ccc3c(c2)OCO3)=N\O)c1Cl | 10.1021/jm9700068 | ||
| 44213923 | 107795 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 563 | 8 | 1 | 8 | 4.1 | COc1ccc(C2=NN(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)C(=O)CC2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL319743 | 107795 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 563 | 8 | 1 | 8 | 4.1 | COc1ccc(C2=NN(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)C(=O)CC2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 11799440 | 205248 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCN(CCC)C(=O)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9132 | 205248 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 4.3 | CCCN(CCC)C(=O)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10506868 | 62927 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.7 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL179138 | 62927 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.7 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10553384 | 109180 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 498 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1cccn1 | 10.1021/jm980217s | ||
| CHEMBL322537 | 109180 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 498 | 13 | 1 | 7 | 3.6 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCn1cccn1 | 10.1021/jm980217s | ||
| 76308472 | 84930 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 6 | 1 | 8 | 3.7 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C#N)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261600 | 84930 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 6 | 1 | 8 | 3.7 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C#N)ccc12 | 10.1007/s00044-004-0021-y | ||
| 71451527 | 81268 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 641 | 15 | 1 | 12 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C2CC2)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163706 | 81268 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 641 | 15 | 1 | 12 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(C2CC2)cn1 | 10.1021/jm3009103 | ||
| 23445313 | 165085 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 5.1 | Cc1cc(C)c(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL424371 | 165085 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 5.1 | Cc1cc(C)c(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| 23445421 | 59615 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.0 | Cc1ccc(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL173189 | 59615 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 5.0 | Cc1ccc(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00133-9 | ||
| 11005242 | 201206 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1)O2 | 10.1021/jm010382z | ||
| CHEMBL62719 | 201206 | 0 | None | - | 0 | Pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1)O2 | 10.1021/jm010382z | ||
| 44212539 | 202394 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 12 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL70203 | 202394 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 12 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44284288 | 99673 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 559 | 9 | 2 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)C(=O)N(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL287683 | 99673 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 559 | 9 | 2 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)C(=O)N(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 44284266 | 136409 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 531 | 8 | 2 | 7 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CN(C)C(C)=O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL37427 | 136409 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 531 | 8 | 2 | 7 | 4.6 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CN(C)C(C)=O)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 44212539 | 202394 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 12 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70203 | 202394 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 671 | 12 | 2 | 12 | 5.9 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 44371449 | 49113 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c(OC)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL156404 | 49113 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c(OC)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| 44298278 | 193001 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 462 | 8 | 2 | 7 | 4.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL53168 | 193001 | 0 | None | - | 0 | Pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 462 | 8 | 2 | 7 | 4.5 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44371670 | 141131 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1082 | 23 | 11 | 10 | 3.7 | CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C1c2ccccc2CCc2ccccc21 | 10.1016/0960-894X(95)00084-7 | ||
| CHEMBL385405 | 141131 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1082 | 23 | 11 | 10 | 3.7 | CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C1c2ccccc2CCc2ccccc21 | 10.1016/0960-894X(95)00084-7 | ||
| CHEMBL432091 | 211884 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | 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]cn1)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/jm00095a029 | ||||
| CHEMBL432091 | 211884 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | 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]cn1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(95)00152-J | ||||
| 10792785 | 166170 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 551 | 10 | 3 | 6 | 5.0 | CCOC(=O)c1nc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)oc1C | 10.1021/jm950592+ | ||
| CHEMBL428298 | 166170 | 0 | None | - | 0 | Pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 551 | 10 | 3 | 6 | 5.0 | CCOC(=O)c1nc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)oc1C | 10.1021/jm950592+ | ||
| 23445221 | 201406 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 470 | 5 | 1 | 7 | 4.4 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL63937 | 201406 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 470 | 5 | 1 | 7 | 4.4 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00367-3 | ||
| 10529742 | 8108 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 511 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1cccn1C | 10.1021/jm980217s | ||
| CHEMBL109206 | 8108 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 511 | 13 | 1 | 6 | 4.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1cccn1C | 10.1021/jm980217s | ||
| 10672494 | 178973 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 483 | 6 | 2 | 6 | 5.0 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(C(C)C)cc2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL47417 | 178973 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 483 | 6 | 2 | 6 | 5.0 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(C(C)C)cc2)c1Br | 10.1021/jm9608366 | ||
| 23445354 | 204909 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 426 | 5 | 1 | 5 | 4.8 | CCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL89203 | 204909 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 426 | 5 | 1 | 5 | 4.8 | CCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| 52944276 | 18245 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 559 | 11 | 3 | 8 | 4.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCCCO)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271807 | 18245 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 559 | 11 | 3 | 8 | 4.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCCCO)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10674642 | 112871 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 574 | 10 | 3 | 7 | 4.7 | CCc1cc(C(=O)O)cc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL331758 | 112871 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 574 | 10 | 3 | 7 | 4.7 | CCc1cc(C(=O)O)cc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 44320291 | 105458 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 548 | 7 | 2 | 8 | 4.8 | O=C(O)c1cc2c(c(Cn3nc(-c4ccccc4)c(Cc4cc5c(cc4Cl)OCO5)c3C(=O)O)c1)OCOC2 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL312854 | 105458 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 548 | 7 | 2 | 8 | 4.8 | O=C(O)c1cc2c(c(Cn3nc(-c4ccccc4)c(Cc4cc5c(cc4Cl)OCO5)c3C(=O)O)c1)OCOC2 | 10.1016/s0960-894x(00)00513-8 | ||
| 10281573 | 59660 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 574 | 9 | 2 | 9 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173358 | 59660 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 574 | 9 | 2 | 9 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 9939960 | 175002 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 704 | 13 | 2 | 11 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)cc(C(=O)N2CCN(C)CC2)cc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4579445 | 175002 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 704 | 13 | 2 | 11 | 5.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)cc(C(=O)N2CCN(C)CC2)cc1OCCOC(=O)Nc1ccccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44320444 | 204717 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 481 | 7 | 2 | 8 | 4.0 | O=C(O)c1cc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)on1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL88019 | 204717 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 481 | 7 | 2 | 8 | 4.0 | O=C(O)c1cc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)on1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44309897 | 202925 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 5 | 1 | 7 | 4.9 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccc4c(c3)OCO4)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL73506 | 202925 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 5 | 1 | 7 | 4.9 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccc4c(c3)OCO4)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(97)10151-2 | ||
| 9936145 | 18837 | 1 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 510 | 11 | 1 | 4 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL128818 | 18837 | 1 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 510 | 11 | 1 | 4 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)c(F)c1 | 10.1021/jm010237l | ||
| 44327890 | 140880 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL384052 | 140880 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 985 | 26 | 9 | 8 | 5.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccccc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 44266537 | 4262 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 507 | 8 | 1 | 6 | 6.4 | COc1ccc(Cn2c(C(=O)O)c(-c3ccc4c(c3)OCO4)c3cc(OCc4ccccc4)ccc32)cc1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10092 | 4262 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 507 | 8 | 1 | 6 | 6.4 | COc1ccc(Cn2c(C(=O)O)c(-c3ccc4c(c3)OCO4)c3cc(OCc4ccccc4)ccc32)cc1 | 10.1016/0960-894X(96)00170-9 | ||
| 71462320 | 81592 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 11 | 2 | 8 | 3.9 | Cc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2165332 | 81592 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 11 | 2 | 8 | 3.9 | Cc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 71462320 | 81592 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 11 | 2 | 8 | 3.9 | Cc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165332 | 81592 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 570 | 11 | 2 | 8 | 3.9 | Cc1ccc(-c2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm3009103 | ||
| 10674176 | 162150 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 548 | 11 | 1 | 9 | 5.0 | CCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OCC)c1OCC | 10.1021/jm9606507 | ||
| CHEMBL417067 | 162150 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 548 | 11 | 1 | 9 | 5.0 | CCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OCC)c1OCC | 10.1021/jm9606507 | ||
| 18184256 | 128961 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 662 | 13 | 2 | 13 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367275 | 128961 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 662 | 13 | 2 | 13 | 3.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10740439 | 172179 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 412 | 5 | 2 | 7 | 3.5 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)nc1 | 10.1021/jm9608366 | ||
| CHEMBL45087 | 172179 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 412 | 5 | 2 | 7 | 3.5 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)nc1 | 10.1021/jm9608366 | ||
| 23445379 | 129577 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.8 | Cc1ccc(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL367776 | 129577 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.8 | Cc1ccc(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL407422 | 210914 | 0 | None | - | 0 | Bovine | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 44284184 | 139470 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 490 | 8 | 2 | 7 | 5.0 | CCOc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL38000 | 139470 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 490 | 8 | 2 | 7 | 5.0 | CCOc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL409433 | 211016 | 0 | None | - | 0 | Bovine | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 44458399 | 98535 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 520 | 7 | 2 | 7 | 4.2 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(CO)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL279947 | 98535 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 520 | 7 | 2 | 7 | 4.2 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(CO)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL313382 | 209367 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | 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/jm00070a001 | ||||
| CHEMBL87243 | 214116 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00070a001 | ||||
| 10288713 | 101573 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 4.6 | CCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL301840 | 101573 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 4.6 | CCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| 10160887 | 99686 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 5 | 1 | 7 | 5.0 | O=C(O)c1c(Sc2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28779 | 99686 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 5 | 1 | 7 | 5.0 | O=C(O)c1c(Sc2ccc3c(c2)OCO3)c2ccccc2n1Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00232-6 | ||
| 10600668 | 5089 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1cc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc(OC)c1OC | 10.1021/jm9606507 | ||
| CHEMBL10589 | 5089 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1cc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc(OC)c1OC | 10.1021/jm9606507 | ||
| 10840410 | 202362 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 550 | 10 | 2 | 10 | 3.3 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL70017 | 202362 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 550 | 10 | 2 | 10 | 3.3 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCC(=O)O)c2)cc1 | 10.1021/jm980504w | ||
| 44327237 | 206191 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 511 | 8 | 1 | 8 | 3.5 | CCCc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL96847 | 206191 | 0 | None | - | 0 | Pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 511 | 8 | 1 | 8 | 3.5 | CCCc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 18617327 | 203545 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1ccccc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78929 | 203545 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1ccccc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44439108 | 166561 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1267 | 53 | 3 | 22 | 5.7 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL429019 | 166561 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1267 | 53 | 3 | 22 | 5.7 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| 22010352 | 117123 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 404 | 10 | 1 | 4 | 5.5 | CC(=O)c1ccc(OCc2ccccc2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL3400984 | 117123 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 404 | 10 | 1 | 4 | 5.5 | CC(=O)c1ccc(OCc2ccccc2)cc1OC(CCC(=O)O)c1ccccc1 | 10.1016/j.bmc.2015.01.003 | ||
| 44339655 | 9018 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 530 | 14 | 1 | 6 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2cc(OC)c3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL109926 | 9018 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 530 | 14 | 1 | 6 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2cc(OC)c3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 11742628 | 97783 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL274383 | 97783 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 5 | 1 | 6 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 9845967 | 10989 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL10801 | 10989 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL1178000 | 10989 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL51530 | 10989 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| 9845967 | 10989 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL10801 | 10989 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1178000 | 10989 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL51530 | 10989 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 416 | 7 | 1 | 5 | 4.4 | COc1ccc(C(=O)/C(Cc2ccccc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 71455064 | 81284 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 694 | 14 | 1 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)N(C)Cc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163721 | 81284 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 694 | 14 | 1 | 12 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)N(C)Cc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 71460621 | 81589 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)c1 | 10.1021/jm3009103 | ||
| CHEMBL2165329 | 81589 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1cccc(Oc2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)c1 | 10.1021/jm3009103 | ||
| 10527706 | 96553 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL266594 | 96553 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44386002 | 59978 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 503 | 9 | 1 | 9 | 3.9 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL174326 | 59978 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 503 | 9 | 1 | 9 | 3.9 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 11015826 | 201837 | 0 | None | - | 0 | Pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 450 | 6 | 1 | 5 | 6.1 | CC(C)Oc1ccc2c(c1)C(CC1CCCCC1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL66426 | 201837 | 0 | None | - | 0 | Pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 450 | 6 | 1 | 5 | 6.1 | CC(C)Oc1ccc2c(c1)C(CC1CCCCC1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 10626646 | 16269 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCc1cccc(CCC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL123305 | 16269 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCc1cccc(CCC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 10240093 | 81275 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 603 | 12 | 1 | 12 | 3.5 | CCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163713 | 81275 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 603 | 12 | 1 | 12 | 3.5 | CCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 44295224 | 14462 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 532 | 9 | 1 | 9 | 4.6 | COc1cc(C/C(C(=O)c2ccc3c(c2)CCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205077 | 14462 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 532 | 9 | 1 | 9 | 4.6 | COc1cc(C/C(C(=O)c2ccc3c(c2)CCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL49675 | 14462 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 532 | 9 | 1 | 9 | 4.6 | COc1cc(C/C(C(=O)c2ccc3c(c2)CCO3)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL316092 | 209449 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00070a001 | ||||
| 15453209 | 203421 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 358 | 3 | 1 | 4 | 3.5 | Cc1cc(C)c(S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL77962 | 203421 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 358 | 3 | 1 | 4 | 3.5 | Cc1cc(C)c(S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 71451526 | 81263 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 635 | 14 | 1 | 12 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Cl)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163701 | 81263 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 635 | 14 | 1 | 12 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncc(Cl)cn1 | 10.1021/jm3009103 | ||
| 67952994 | 81594 | 11 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 634 | 11 | 2 | 8 | 4.4 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165334 | 81594 | 11 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 634 | 11 | 2 | 8 | 4.4 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 10145418 | 81260 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 14 | 1 | 12 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2163698 | 81260 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 14 | 1 | 12 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10145418 | 81260 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 14 | 1 | 12 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| CHEMBL2163698 | 81260 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 601 | 14 | 1 | 12 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| 44386163 | 60061 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 577 | 14 | 2 | 10 | 3.4 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL174781 | 60061 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 577 | 14 | 2 | 10 | 3.4 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 71453356 | 81253 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 554 | 13 | 2 | 10 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1cccc(OC)c1 | 10.1021/jm3009103 | ||
| CHEMBL2163691 | 81253 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 554 | 13 | 2 | 10 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1Oc1cccc(OC)c1 | 10.1021/jm3009103 | ||
| 44439106 | 153073 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 1005 | 37 | 2 | 17 | 5.8 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL398070 | 153073 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 1005 | 37 | 2 | 17 | 5.8 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2ccno2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| 10579100 | 165788 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(Cc2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL122614 | 165788 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(Cc2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL427303 | 165788 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 578 | 10 | 2 | 6 | 5.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(Cc2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 10006086 | 120549 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 9 | 2 | 5 | 4.6 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL356916 | 120549 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 9 | 2 | 5 | 4.6 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL414131 | 211365 | 0 | None | - | 0 | Bovine | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](C)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 11059249 | 102145 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 440 | 10 | 1 | 6 | 5.3 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCCCC)cc21 | 10.1021/jm010382z | ||
| CHEMBL304202 | 102145 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 440 | 10 | 1 | 6 | 5.3 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCCCC)cc21 | 10.1021/jm010382z | ||
| 11733231 | 201156 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1cccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)c1 | 10.1021/jm010382z | ||
| CHEMBL62465 | 201156 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 460 | 6 | 1 | 6 | 5.2 | COc1cccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)c1 | 10.1021/jm010382z | ||
| CHEMBL431433 | 211877 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 18617340 | 104924 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 4 | 1 | 4 | 3.9 | CCc1ccc(Br)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311742 | 104924 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 4 | 1 | 4 | 3.9 | CCc1ccc(Br)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 44279439 | 106894 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 534 | 3 | 2 | 3 | 6.2 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL31781 | 106894 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 534 | 3 | 2 | 3 | 6.2 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL303204 | 209173 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00089a028 | ||||
| 44317005 | 203317 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76949 | 203317 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10116355 | 8182 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 474 | 14 | 1 | 5 | 4.9 | CCCCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL109248 | 8182 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 474 | 14 | 1 | 5 | 4.9 | CCCCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 11799503 | 9661 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 498 | 13 | 1 | 6 | 4.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccco1 | 10.1021/jm980217s | ||
| CHEMBL113472 | 9661 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 498 | 13 | 1 | 6 | 4.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCc1ccco1 | 10.1021/jm980217s | ||
| 10095637 | 49697 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 457 | 9 | 1 | 5 | 5.8 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)O)c1ccccc1 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL15689 | 49697 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 457 | 9 | 1 | 5 | 5.8 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)O)c1ccccc1 | 10.1016/0960-894X(95)00186-W | ||
| 44459247 | 87595 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 575 | 8 | 1 | 7 | 4.9 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)N(C)C)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL23444 | 87595 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 575 | 8 | 1 | 7 | 4.9 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)N(C)C)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 10649546 | 108127 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 516 | 13 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1CCCCO1 | 10.1021/jm980217s | ||
| CHEMBL320569 | 108127 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 516 | 13 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1CCCCO1 | 10.1021/jm980217s | ||
| 44284405 | 99892 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 532 | 10 | 2 | 7 | 5.4 | COCC(C)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL289634 | 99892 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 532 | 10 | 2 | 7 | 5.4 | COCC(C)Cc1cc(OC)ccc1[C@@H]1c2nc(NC(C)C)ccc2[C@H](c2ccc3c(c2)OCO3)[C@H]1C(=O)O | 10.1016/j.bmcl.2004.01.008 | ||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/S0960-894X(97)00002-4 | ||
| 10971938 | 201287 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 7 | 1 | 5 | 5.6 | CC(C)CCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL63058 | 201287 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 424 | 7 | 1 | 5 | 5.6 | CC(C)CCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 44295156 | 14458 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccccc1C(=O)/C(Cc1cc(OC)c(OC)c(OC)c1)=C(\C(=O)O)c1ccc2nsnc2c1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205062 | 14458 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccccc1C(=O)/C(Cc1cc(OC)c(OC)c(OC)c1)=C(\C(=O)O)c1ccc2nsnc2c1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL48411 | 14458 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 520 | 10 | 1 | 9 | 4.7 | COc1ccccc1C(=O)/C(Cc1cc(OC)c(OC)c(OC)c1)=C(\C(=O)O)c1ccc2nsnc2c1 | 10.1016/s0960-894x(98)00301-1 | ||
| 44284199 | 99648 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 552 | 9 | 2 | 7 | 6.2 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL287517 | 99648 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 552 | 9 | 2 | 7 | 6.2 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OCc2ccccc2)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 10961277 | 100548 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 446 | 5 | 2 | 6 | 4.9 | CC(C)Oc1ccc2c(c1)C(c1ccc(O)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL294496 | 100548 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 446 | 5 | 2 | 6 | 4.9 | CC(C)Oc1ccc2c(c1)C(c1ccc(O)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 10788494 | 170056 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL445101 | 170056 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 424 | 6 | 1 | 6 | 4.5 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1021/jm9700068 | ||
| CHEMBL133257 | 206973 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](C2CCCC2)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 44339840 | 9198 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 486 | 13 | 1 | 5 | 5.1 | C/C=C(\C)CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL110904 | 9198 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 486 | 13 | 1 | 5 | 5.1 | C/C=C(\C)CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 10816110 | 108079 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 532 | 13 | 1 | 7 | 4.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1OC(C)C(C)O1 | 10.1021/jm980217s | ||
| CHEMBL320254 | 108079 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 532 | 13 | 1 | 7 | 4.2 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1OC(C)C(C)O1 | 10.1021/jm980217s | ||
| 10530156 | 9466 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 526 | 14 | 1 | 6 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(OC)cc2OC)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL112347 | 9466 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 526 | 14 | 1 | 6 | 5.0 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(OC)cc2OC)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10579210 | 168026 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 585 | 10 | 4 | 6 | 5.4 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL435901 | 168026 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 585 | 10 | 4 | 6 | 5.4 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10673969 | 61776 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 538 | 10 | 3 | 7 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL177546 | 61776 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 538 | 10 | 3 | 7 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 22998414 | 201327 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 422 | 5 | 1 | 9 | 3.1 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1C | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL63290 | 201327 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 422 | 5 | 1 | 9 | 3.1 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1C | 10.1016/S0960-894X(97)00367-3 | ||
| 10231591 | 130838 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 569 | 10 | 2 | 11 | 2.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368828 | 130838 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 569 | 10 | 2 | 11 | 2.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 44311232 | 202408 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 658 | 13 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70293 | 202408 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 658 | 13 | 2 | 13 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ncccn2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 18995989 | 100089 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 583 | 9 | 1 | 9 | 6.6 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL29147 | 100089 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 583 | 9 | 1 | 9 | 6.6 | COc1cc2c(Sc3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00232-6 | ||
| 10426645 | 162525 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL417651 | 162525 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 11728313 | 162724 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 368 | 6 | 1 | 5 | 4.2 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| CHEMBL418667 | 162724 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 368 | 6 | 1 | 5 | 4.2 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccccc21 | 10.1021/jm010382z | ||
| 44368396 | 44340 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 506 | 8 | 2 | 5 | 4.9 | COc1ccc(C(=O)N(Cc2cc3c(cc2Cl)OCO3)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152017 | 44340 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 506 | 8 | 2 | 5 | 4.9 | COc1ccc(C(=O)N(Cc2cc3c(cc2Cl)OCO3)C(Cc2c[nH]c3ccccc23)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 10357554 | 97115 | 1 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 302 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2cccc3ccccc23)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL27065 | 97115 | 1 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 302 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2cccc3ccccc23)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 44316973 | 203893 | 2 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1noc(NS(=O)(=O)c2cccc(Br)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL81593 | 203893 | 2 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 330 | 3 | 1 | 4 | 2.9 | Cc1noc(NS(=O)(=O)c2cccc(Br)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 44439114 | 161081 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 993 | 32 | 2 | 15 | 7.3 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOc2ccc(CCC(=O)N(C)Cc3cc(-c4ncco4)ccc3-c3ccccc3S(=O)(=O)Nc3ccno3)cc2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL413001 | 161081 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 993 | 32 | 2 | 15 | 7.3 | CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOc2ccc(CCC(=O)N(C)Cc3cc(-c4ncco4)ccc3-c3ccccc3S(=O)(=O)Nc3ccno3)cc2)cc1 | 10.1016/j.bmcl.2006.10.009 | ||
| 10812400 | 97927 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 427 | 9 | 1 | 6 | 3.7 | CCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL275306 | 97927 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 427 | 9 | 1 | 6 | 3.7 | CCCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10816667 | 11339 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 558 | 9 | 2 | 6 | 5.6 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180341 | 11339 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 558 | 9 | 2 | 6 | 5.6 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL122933 | 11339 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 558 | 9 | 2 | 6 | 5.6 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(CC(C)(C)C)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 10768903 | 12028 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 544 | 11 | 2 | 6 | 5.3 | CCCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL1184133 | 12028 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 544 | 11 | 2 | 6 | 5.3 | CCCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL334076 | 12028 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 544 | 11 | 2 | 6 | 5.3 | CCCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| 44314579 | 102444 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL306123 | 102444 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 580 | 12 | 5 | 5 | 3.8 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| 44314722 | 155210 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 597 | 14 | 5 | 4 | 4.9 | CCCCC(NC(=O)[C@@H](Cc1c(CC)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL405724 | 155210 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 597 | 14 | 5 | 4 | 4.9 | CCCCC(NC(=O)[C@@H](Cc1c(CC)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44283421 | 99694 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 597 | 14 | 5 | 4 | 4.9 | CCCC[C@H](NC(=O)[C@@H](Cc1c(CC)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL287888 | 99694 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 597 | 14 | 5 | 4 | 4.9 | CCCC[C@H](NC(=O)[C@@H](Cc1c(CC)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 9809919 | 202704 | 0 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL72037 | 202704 | 0 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 665 | 13 | 2 | 13 | 4.5 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10209320 | 9195 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 546 | 12 | 1 | 7 | 4.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CC(C)C | 10.1021/jm970101g | ||
| CHEMBL110899 | 9195 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 546 | 12 | 1 | 7 | 4.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CC(C)C | 10.1021/jm970101g | ||
| 10579303 | 9340 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 16 | 1 | 8 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCOC)cc1 | 10.1021/jm970101g | ||
| CHEMBL111712 | 9340 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 590 | 16 | 1 | 8 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCOC)cc1 | 10.1021/jm970101g | ||
| 44314864 | 102562 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 11 | 5 | 5 | 3.4 | CCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL307077 | 102562 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 11 | 5 | 5 | 3.4 | CCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| 44314751 | 160808 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL412602 | 160808 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44283349 | 99862 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCC[C@H](NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| CHEMBL289410 | 99862 | 0 | None | - | 0 | Pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 603 | 13 | 5 | 4 | 5.0 | CCCC[C@H](NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1016/0960-894X(95)00237-N | ||
| 44284437 | 99522 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 520 | 9 | 4 | 8 | 3.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(O)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL286621 | 99522 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 520 | 9 | 4 | 8 | 3.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(O)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 10506430 | 113291 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 532 | 9 | 2 | 7 | 4.5 | CCc1cccc(OC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL332387 | 113291 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 532 | 9 | 2 | 7 | 4.5 | CCc1cccc(OC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL313984 | 209377 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| 10188517 | 61437 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 582 | 9 | 2 | 10 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL177203 | 61437 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 582 | 9 | 2 | 10 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 9850566 | 4130 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 551 | 8 | 1 | 8 | 6.1 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10016 | 4130 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 551 | 8 | 1 | 8 | 6.1 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2cc1OCc1ccccc1 | 10.1016/0960-894X(96)00170-9 | ||
| 44298305 | 192990 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 504 | 10 | 2 | 7 | 5.3 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(=O)O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL53097 | 192990 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 504 | 10 | 2 | 7 | 5.3 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC(=O)O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44298277 | 193329 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 474 | 9 | 1 | 7 | 5.1 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54773 | 193329 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 474 | 9 | 1 | 7 | 5.1 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCC=O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 44298988 | 100252 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL292580 | 100252 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 459 | 8 | 1 | 6 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| 3911 | 3265 | 0 | None | - | 0 | Bovine | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL429908 | 3265 | 0 | None | - | 0 | Bovine | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00296-5 | ||||
| CHEMBL329609 | 209572 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10649266 | 9541 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3ccoc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL112685 | 9541 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3ccoc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 22010244 | 205074 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 9 | 1 | 5 | 5.5 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C#N | 10.1021/jm9707131 | ||
| CHEMBL90320 | 205074 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 9 | 1 | 5 | 5.5 | Cc1ccccc1C(CCC(=O)O)Oc1cc(OCc2ccsc2)ccc1C#N | 10.1021/jm9707131 | ||
| 10649585 | 109285 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 518 | 14 | 1 | 7 | 3.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCC1OCCO1 | 10.1021/jm980217s | ||
| CHEMBL323175 | 109285 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 518 | 14 | 1 | 7 | 3.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCCC1OCCO1 | 10.1021/jm980217s | ||
| 44383592 | 59588 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.6 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| CHEMBL173059 | 59588 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.6 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| 44265853 | 204676 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 4 | 1 | 6 | 2.7 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)N2CCOCC2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8776 | 204676 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 4 | 1 | 6 | 2.7 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2C(=O)N2CCOCC2)cc1 | 10.1021/jm9505369 | ||
| 21979593 | 81593 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 590 | 11 | 2 | 8 | 4.3 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Cl)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165333 | 81593 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 590 | 11 | 2 | 8 | 4.3 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Cl)cc1 | 10.1021/jm3009103 | ||
| 71455139 | 81591 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 556 | 11 | 2 | 8 | 3.6 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccccc1 | 10.1021/jm3009103 | ||
| CHEMBL2165331 | 81591 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 556 | 11 | 2 | 8 | 3.6 | O=S(=O)(NCc1ccccc1)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccccc1 | 10.1021/jm3009103 | ||
| 10391487 | 9570 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3occc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL112832 | 9570 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3occc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL319660 | 209474 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 44284115 | 99732 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 518 | 9 | 3 | 7 | 4.8 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL288247 | 99732 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 518 | 9 | 3 | 7 | 4.8 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 10391487 | 9570 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3occc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL112832 | 9570 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 506 | 12 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3occc3c2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 44266903 | 14417 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 11 | 1 | 9 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10862 | 14417 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 11 | 1 | 9 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL1204672 | 14417 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 11 | 1 | 9 | 4.4 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 44387124 | 130369 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 524 | 13 | 1 | 6 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](CC(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm031041j | ||
| CHEMBL368558 | 130369 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 524 | 13 | 1 | 6 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](CC(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm031041j | ||
| 159594 | 518 | 38 | None | -4073 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| 3487 | 518 | 38 | None | -4073 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| CHEMBL9194 | 518 | 38 | None | -4073 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| DB06199 | 518 | 38 | None | -4073 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| 9914310 | 204917 | 3 | None | - | 2 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8923 | 204917 | 3 | None | - | 2 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 21041273 | 173176 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 12 | 2 | 9 | 2.8 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(OC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4536769 | 173176 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 12 | 2 | 9 | 2.8 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(OC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10575845 | 11125 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 457 | 7 | 2 | 8 | 3.8 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(OC)c1 | 10.1021/jm9608366 | ||
| CHEMBL1178807 | 11125 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 457 | 7 | 2 | 8 | 3.8 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(OC)c1 | 10.1021/jm9608366 | ||
| CHEMBL43788 | 11125 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 457 | 7 | 2 | 8 | 3.8 | COc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(OC)c1 | 10.1021/jm9608366 | ||
| CHEMBL97470 | 214148 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 11732669 | 201427 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCCC)cc21 | 10.1021/jm010382z | ||
| CHEMBL64039 | 201427 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OCCC)cc21 | 10.1021/jm010382z | ||
| 44298343 | 101323 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 485 | 9 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC#N)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL300066 | 101323 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 485 | 9 | 1 | 7 | 5.8 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCCC#N)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 159594 | 518 | 38 | None | - | 3 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm960077r | ||
| 3487 | 518 | 38 | None | - | 3 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm960077r | ||
| CHEMBL9194 | 518 | 38 | None | - | 3 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm960077r | ||
| DB06199 | 518 | 38 | None | - | 3 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm960077r | ||
| 44371420 | 50637 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cccc(OC)c3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL157763 | 50637 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3cccc(OC)c3OC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 9888574 | 103699 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 4 | 1 | 4 | 3.9 | CCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL309692 | 103699 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 4 | 1 | 4 | 3.9 | CCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10429404 | 104399 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 372 | 5 | 1 | 4 | 3.7 | CCc1ccc(CC)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311138 | 104399 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 372 | 5 | 1 | 4 | 3.7 | CCc1ccc(CC)c(S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 10670372 | 96798 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)cc(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL268754 | 96798 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)cc(OC)c3)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 44327423 | 205807 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)nc1C | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94720 | 205807 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 483 | 6 | 1 | 8 | 2.8 | Cc1cc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)nc1C | 10.1016/S0960-894X(96)00617-8 | ||
| 10915215 | 100336 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 354 | 4 | 1 | 5 | 3.8 | CC(C)Oc1ccc2c(c1)C=C(C(=O)O)[C@@H](c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL293161 | 100336 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 354 | 4 | 1 | 5 | 3.8 | CC(C)Oc1ccc2c(c1)C=C(C(=O)O)[C@@H](c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 44305079 | 101621 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 354 | 4 | 1 | 5 | 3.8 | CC(C)Oc1ccc2c(c1)C=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL302189 | 101621 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 354 | 4 | 1 | 5 | 3.8 | CC(C)Oc1ccc2c(c1)C=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 21041249 | 81250 | 1 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 648 | 11 | 1 | 8 | 4.7 | CN(Cc1ccccc1)S(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2163688 | 81250 | 1 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 648 | 11 | 1 | 8 | 4.7 | CN(Cc1ccccc1)S(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 44384656 | 129573 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 468 | 5 | 1 | 7 | 4.5 | Cc1noc(NS(=O)(=O)c2ccsc2/C=C/c2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL367763 | 129573 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 468 | 5 | 1 | 7 | 4.5 | Cc1noc(NS(=O)(=O)c2ccsc2/C=C/c2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 21979601 | 81588 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)ncnc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2165328 | 81588 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)ncnc1OCCOc1ncc(Br)cn1 | 10.1016/j.bmcl.2016.06.014 | ||
| 21979601 | 81588 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)ncnc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2165328 | 81588 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 602 | 13 | 2 | 10 | 3.7 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)ncnc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 10647372 | 205388 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCN(CC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9212 | 205388 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 8 | 1 | 6 | 3.1 | CCN(CC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL2304016 | 207727 | 0 | None | - | 0 | Pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC(C)[C@H]1NC(=O)[C@H](C(C)(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Cl)[nH]c3ccccc23)NC1=O | 10.1021/jm9600914 | ||||
| 44333889 | 5014 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 463 | 7 | 1 | 6 | 5.3 | CCCSc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL105494 | 5014 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 463 | 7 | 1 | 6 | 5.3 | CCCSc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44334084 | 109165 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 3.8 | COc1ccc([C@@H]2c3nc(CCC(=O)O)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL322434 | 109165 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 461 | 7 | 2 | 6 | 3.8 | COc1ccc([C@@H]2c3nc(CCC(=O)O)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 18617333 | 105048 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 424 | 4 | 1 | 5 | 3.3 | COc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL312187 | 105048 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 424 | 4 | 1 | 5 | 3.3 | COc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44309488 | 202311 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 471 | 7 | 1 | 8 | 5.1 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2nonc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| CHEMBL69664 | 202311 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 471 | 7 | 1 | 8 | 5.1 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2nonc2c1 | 10.1016/s0960-894x(97)10151-2 | ||
| 10814655 | 205866 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCCN(CC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9502 | 205866 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCCN(CC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44385127 | 61039 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 482 | 5 | 1 | 7 | 4.8 | Cc1cc2c(cc1/C=C/c1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL176854 | 61039 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 482 | 5 | 1 | 7 | 4.8 | Cc1cc2c(cc1/C=C/c1ccsc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL409339 | 211014 | 0 | None | - | 0 | Bovine | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 44284115 | 99732 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 518 | 9 | 3 | 7 | 4.8 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL288247 | 99732 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 518 | 9 | 3 | 7 | 4.8 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 11826173 | 201132 | 1 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL62363 | 201132 | 1 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC)cc32)cc1 | 10.1021/jm010382z | ||
| 44298956 | 194007 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 489 | 9 | 1 | 7 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1OC)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL55666 | 194007 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 489 | 9 | 1 | 7 | 4.8 | CCOc1ccc2c(c1)c(-c1ccc(OC)cc1OC)c(C(=O)O)c(=O)n2Cc1ccccc1OC | 10.1016/S0960-894X(97)00319-3 | ||
| 44270602 | 98402 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 688 | 13 | 1 | 10 | 7.0 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1cccs1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL278930 | 98402 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 688 | 13 | 1 | 10 | 7.0 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1cccs1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 10553165 | 9648 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 492 | 7 | 1 | 6 | 5.4 | O=C1OC(O)(c2ccc(OCc3ccccc3)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| CHEMBL11341 | 9648 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 492 | 7 | 1 | 6 | 5.4 | O=C1OC(O)(c2ccc(OCc3ccccc3)cc2)C(Cc2ccccc2)=C1c1ccc2c(c1)OCO2 | 10.1021/jm9606507 | ||
| 44276946 | 106363 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3cc(Cl)c4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144735 | 106363 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 440 | 5 | 1 | 5 | 4.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3cc(Cl)c4c(c3)OCO4)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 10650062 | 60123 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 537 | 10 | 4 | 6 | 4.8 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL175228 | 60123 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 537 | 10 | 4 | 6 | 4.8 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)NC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 18184206 | 60013 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 600 | 13 | 2 | 11 | 3.2 | CCS(=O)(=O)NCCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL174413 | 60013 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 600 | 13 | 2 | 11 | 3.2 | CCS(=O)(=O)NCCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 155564169 | 174761 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 545 | 11 | 1 | 12 | 2.0 | COc1ccc(Cl)c(Oc2c(NS(C)(=O)=O)ncnc2OCCOc2ncc(S(C)(=O)=O)cn2)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4574034 | 174761 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 545 | 11 | 1 | 12 | 2.0 | COc1ccc(Cl)c(Oc2c(NS(C)(=O)=O)ncnc2OCCOc2ncc(S(C)(=O)=O)cn2)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| 42630655 | 18223 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 11 | 2 | 7 | 5.5 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1271586 | 18223 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 11 | 2 | 7 | 5.5 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 42630655 | 18223 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 11 | 2 | 7 | 5.5 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1271586 | 18223 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 11 | 2 | 7 | 5.5 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 17869231 | 14457 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 548 | 11 | 1 | 9 | 5.5 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1205061 | 14457 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 548 | 11 | 1 | 9 | 5.5 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL48315 | 14457 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 548 | 11 | 1 | 9 | 5.5 | COc1cc(C/C(C(=O)c2ccc(OC(C)C)cc2)=C(/C(=O)O)c2ccc3nsnc3c2)cc(OC)c1OC | 10.1016/s0960-894x(98)00301-1 | ||
| 44327412 | 205847 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 497 | 5 | 1 | 8 | 3.0 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94929 | 205847 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 497 | 5 | 1 | 8 | 3.0 | Cc1cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44367767 | 43501 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 469 | 9 | 2 | 6 | 4.5 | COc1ccc(CN(Cc2cc3c(cc2Cl)OCO3)C(Cc2ccc(O)cc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL151064 | 43501 | 0 | None | - | 0 | Pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 469 | 9 | 2 | 6 | 4.5 | COc1ccc(CN(Cc2cc3c(cc2Cl)OCO3)C(Cc2ccc(O)cc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 10814746 | 181012 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 484 | 6 | 1 | 8 | 3.8 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL47706 | 181012 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 484 | 6 | 1 | 8 | 3.8 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 44368481 | 121006 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 435 | 9 | 2 | 7 | 2.8 | CCOC(=O)CN(Cc1cc2c(cc1Cl)OCO2)C(Cc1ccc(O)cc1)C(=O)O | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL358444 | 121006 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 435 | 9 | 2 | 7 | 2.8 | CCOC(=O)CN(Cc1cc2c(cc1Cl)OCO2)C(Cc1ccc(O)cc1)C(=O)O | 10.1016/s0960-894x(01)00009-9 | ||
| 9840391 | 104060 | 6 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL310427 | 104060 | 6 | None | - | 1 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10721386 | 60056 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 550 | 11 | 5 | 5 | 4.8 | CCn1cc(C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)c2nc(C(=O)O)c(C)[nH]2)c2ccccc21 | 10.1021/jm950592+ | ||
| CHEMBL174686 | 60056 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 550 | 11 | 5 | 5 | 4.8 | CCn1cc(C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCC2)c2nc(C(=O)O)c(C)[nH]2)c2ccccc21 | 10.1021/jm950592+ | ||
| 44386535 | 130843 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.9 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2cccc(F)c2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368853 | 130843 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.9 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2cccc(F)c2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL414165 | 211367 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](c2cccs2)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 71451528 | 81277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 631 | 14 | 1 | 12 | 4.3 | CCCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2163715 | 81277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 631 | 14 | 1 | 12 | 4.3 | CCCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1016/j.bmcl.2016.06.014 | ||
| 71451528 | 81277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 631 | 14 | 1 | 12 | 4.3 | CCCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163715 | 81277 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 631 | 14 | 1 | 12 | 4.3 | CCCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 71462248 | 81291 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 676 | 17 | 2 | 12 | 3.8 | COCCOc1nc(NS(=O)(=O)NCc2ccccc2)c(Oc2ccccc2OC)c(OCCOc2ncc(Br)cn2)n1 | 10.1021/jm3009103 | ||
| CHEMBL2163728 | 81291 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 676 | 17 | 2 | 12 | 3.8 | COCCOc1nc(NS(=O)(=O)NCc2ccccc2)c(Oc2ccccc2OC)c(OCCOc2ncc(Br)cn2)n1 | 10.1021/jm3009103 | ||
| 21041307 | 174397 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 482 | 10 | 2 | 9 | 2.6 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4566095 | 174397 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 482 | 10 | 2 | 9 | 2.6 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL265116 | 208890 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 44298324 | 194196 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 448 | 7 | 2 | 7 | 4.4 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL55876 | 194196 | 0 | None | - | 0 | Pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 448 | 7 | 2 | 7 | 4.4 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CO)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 9869444 | 96797 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2c1 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL268751 | 96797 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2c1 | 10.1016/0960-894X(96)00170-9 | ||
| 10769045 | 130695 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 551 | 10 | 4 | 6 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2(C)CCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368641 | 130695 | 0 | None | - | 0 | Pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 551 | 10 | 4 | 6 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2(C)CCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 71455065 | 81287 | 1 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 679 | 14 | 2 | 11 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ccncc2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| CHEMBL2163724 | 81287 | 1 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 679 | 14 | 2 | 11 | 4.8 | COc1ccccc1Oc1c(NS(=O)(=O)NCc2ccccc2)nc(-c2ccncc2)nc1OCCOc1ncc(Br)cn1 | 10.1021/jm3009103 | ||
| 137655285 | 158431 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 568 | 10 | 3 | 10 | 3.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCCN)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4096211 | 158431 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 568 | 10 | 3 | 10 | 3.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCCN)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 23445219 | 111983 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1cccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL329861 | 111983 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1cccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| 10129267 | 81276 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 617 | 13 | 1 | 12 | 3.9 | CCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163714 | 81276 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 617 | 13 | 1 | 12 | 3.9 | CCCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 44384723 | 130365 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 563 | 13 | 2 | 10 | 3.0 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368528 | 130365 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 563 | 13 | 2 | 10 | 3.0 | CCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 58688008 | 174730 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 496 | 11 | 2 | 9 | 3.0 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4573273 | 174730 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 496 | 11 | 2 | 9 | 3.0 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 155563100 | 174704 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 619 | 13 | 2 | 10 | 4.6 | COc1cnc(OCCOc2nc(-c3ccncc3)nc(NS(=O)(=O)NCc3ccccc3)c2-c2ccc(Cl)cc2)nc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4572734 | 174704 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 619 | 13 | 2 | 10 | 4.6 | COc1cnc(OCCOc2nc(-c3ccncc3)nc(NS(=O)(=O)NCc3ccccc3)c2-c2ccc(Cl)cc2)nc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9829478 | 174753 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 567 | 10 | 1 | 8 | 4.9 | Cc1ccc(-c2c(NS(=O)(=O)/C=C/c3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4573806 | 174753 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 567 | 10 | 1 | 8 | 4.9 | Cc1ccc(-c2c(NS(=O)(=O)/C=C/c3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10281929 | 9303 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 588 | 16 | 1 | 7 | 5.3 | CCCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL111517 | 9303 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 588 | 16 | 1 | 7 | 5.3 | CCCCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 10816152 | 16157 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 534 | 9 | 2 | 8 | 3.9 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(OC)cccc2OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL122832 | 16157 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 534 | 9 | 2 | 8 | 3.9 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2c(OC)cccc2OC)cc1 | 10.1021/jm990170q | ||
| 9826741 | 100290 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 486 | 5 | 1 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL292802 | 100290 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 486 | 5 | 1 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| 44327734 | 206360 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 561 | 8 | 1 | 9 | 3.9 | COc1ccc(-c2ccc(=O)n(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)n2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL97851 | 206360 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 561 | 8 | 1 | 9 | 3.9 | COc1ccc(-c2ccc(=O)n(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)n2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 10265127 | 96388 | 2 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 270 | 3 | 1 | 4 | 2.2 | Cc1noc(NS(=O)(=O)c2ccc(F)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL26522 | 96388 | 2 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 270 | 3 | 1 | 4 | 2.2 | Cc1noc(NS(=O)(=O)c2ccc(F)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10076527 | 14446 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 7 | 2 | 6 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3ccccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1204990 | 14446 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 485 | 7 | 2 | 6 | 4.3 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3ccccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 22467237 | 84919 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 549 | 8 | 3 | 8 | 2.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(CC(=O)O)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261357 | 84919 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 549 | 8 | 3 | 8 | 2.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccc(CC(=O)O)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1007/s00044-004-0021-y | ||
| 9826741 | 100290 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 486 | 5 | 1 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL292802 | 100290 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 486 | 5 | 1 | 9 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00367-3 | ||
| 10599230 | 205267 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 440 | 8 | 2 | 6 | 2.8 | CCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9141 | 205267 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 440 | 8 | 2 | 6 | 2.8 | CCCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 11113541 | 201577 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 7 | 5.2 | COc1ccc(OC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64632 | 201577 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 7 | 5.2 | COc1ccc(OC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 11015023 | 102247 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 406 | 3 | 1 | 4 | 5.1 | O=C(O)C1=C(c2ccc(Cl)cc2)c2ccccc2OC1c1ccc2c(c1)OCO2 | 10.1021/jm010382z | ||
| CHEMBL304875 | 102247 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 406 | 3 | 1 | 4 | 5.1 | O=C(O)C1=C(c2ccc(Cl)cc2)c2ccccc2OC1c1ccc2c(c1)OCO2 | 10.1021/jm010382z | ||
| 11826259 | 201216 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 437 | 8 | 1 | 7 | 4.5 | CC(C)Oc1ccc2c(c1)C(OCCCC#N)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL62759 | 201216 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 437 | 8 | 1 | 7 | 4.5 | CC(C)Oc1ccc2c(c1)C(OCCCC#N)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 44316527 | 203769 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 280 | 3 | 1 | 4 | 2.7 | Cc1ccc(C)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80532 | 203769 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 280 | 3 | 1 | 4 | 2.7 | Cc1ccc(C)c(S(=O)(=O)Nc2onc(C)c2C)c1 | 10.1016/0960-894X(96)00441-6 | ||
| 10211772 | 56229 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 660 | 11 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL163638 | 56229 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 660 | 11 | 2 | 12 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10815167 | 100723 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 7 | 2 | 6 | 5.4 | CCC(C)c1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL295697 | 100723 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 7 | 2 | 6 | 5.4 | CCC(C)c1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL2304015 | 207726 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | Cc1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@@H](C2CC2)NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC1=O | 10.1021/jm9600914 | ||||
| CHEMBL405599 | 210821 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 44328019 | 155163 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1000 | 26 | 9 | 8 | 5.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL405178 | 155163 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1000 | 26 | 9 | 8 | 5.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 44327347 | 96315 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL264579 | 96315 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1102 | 26 | 9 | 8 | 7.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C1c2ccccc2CCc2ccccc21)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 10961510 | 201147 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.6 | COc1ccc(C2=C(C(=O)O)C(c3ccc(C(C)C)cc3)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL62425 | 201147 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.6 | COc1ccc(C2=C(C(=O)O)C(c3ccc(C(C)C)cc3)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 10696788 | 175342 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 501 | 5 | 2 | 9 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2NC(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| CHEMBL45872 | 175342 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 501 | 5 | 2 | 9 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2NC(=O)Oc2ccc3c(c2)OCO3)c1Br | 10.1021/jm9700068 | ||
| 44316526 | 203710 | 2 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 344 | 3 | 1 | 4 | 3.2 | Cc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80180 | 203710 | 2 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 344 | 3 | 1 | 4 | 3.2 | Cc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 23445506 | 112066 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1ccccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL330003 | 112066 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1ccccc1-c1ccsc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 23445227 | 120312 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 472 | 6 | 1 | 8 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2COc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL355800 | 120312 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 472 | 6 | 1 | 8 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2COc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| 10719598 | 205262 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9139 | 205262 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCN(CCC)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44284437 | 99522 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 520 | 9 | 4 | 8 | 3.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(O)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL286621 | 99522 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 520 | 9 | 4 | 8 | 3.5 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(O)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 10722389 | 12019 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 606 | 10 | 2 | 6 | 6.0 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL1184099 | 12019 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 606 | 10 | 2 | 6 | 6.0 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| CHEMBL332424 | 12019 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 606 | 10 | 2 | 6 | 6.0 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1C | 10.1021/jm990171i | ||
| 44314661 | 102551 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 603 | 14 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CCCC)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL306977 | 102551 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 603 | 14 | 5 | 4 | 5.1 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CCCC)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 44314645 | 172103 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 601 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC1CC1)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL449962 | 172103 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 601 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CC1CC1)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| 10507211 | 109882 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 566 | 13 | 1 | 7 | 3.9 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL324214 | 109882 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 566 | 13 | 1 | 7 | 3.9 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCCCl | 10.1021/jm970101g | ||
| CHEMBL438745 | 212045 | 0 | None | - | 0 | Bovine | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 44320783 | 106211 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccnc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL314357 | 106211 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 453 | 6 | 1 | 6 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccnc2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 1009 | 192 | 20 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| 5310991 | 192 | 20 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| CHEMBL332794 | 192 | 20 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10.1021/jm990170q | ||
| 10841576 | 11338 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 620 | 11 | 2 | 6 | 6.3 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1CC | 10.1021/jm990171i | ||
| CHEMBL1180336 | 11338 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 620 | 11 | 2 | 6 | 6.3 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1CC | 10.1021/jm990171i | ||
| CHEMBL122673 | 11338 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 620 | 11 | 2 | 6 | 6.3 | CCc1ccccc1C(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1CC | 10.1021/jm990171i | ||
| 10650477 | 113750 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 558 | 10 | 2 | 6 | 5.8 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC(C)C)cc1 | 10.1021/jm990170q | ||
| CHEMBL333009 | 113750 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 558 | 10 | 2 | 6 | 5.8 | CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC(C)C)cc1 | 10.1021/jm990170q | ||
| 10209319 | 9280 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 13 | 1 | 7 | 4.1 | CCCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCC | 10.1021/jm970101g | ||
| CHEMBL111355 | 9280 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 13 | 1 | 7 | 4.1 | CCCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCC | 10.1021/jm970101g | ||
| CHEMBL412460 | 211244 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | 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]cn1)NC(=O)[C@H]1CSSC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)80156-6 | ||||
| CHEMBL328942 | 209570 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| CHEMBL433349 | 211889 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 9896251 | 98318 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 682 | 12 | 1 | 9 | 7.1 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm020138n | ||
| CHEMBL278176 | 98318 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 682 | 12 | 1 | 9 | 7.1 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm020138n | ||
| 44213959 | 169800 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 592 | 11 | 3 | 9 | 5.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(=O)Nc2ccccc2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4447655 | 169800 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 592 | 11 | 3 | 9 | 5.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C(=O)Nc2ccccc2)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL313984 | 209377 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| CHEMBL1791271 | 207173 | 2 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 9896251 | 98318 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 682 | 12 | 1 | 9 | 7.1 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL278176 | 98318 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 682 | 12 | 1 | 9 | 7.1 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 44404967 | 134895 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 680 | 12 | 1 | 8 | 7.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCC2 | 10.1021/jm058225d | ||
| CHEMBL372814 | 134895 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 680 | 12 | 1 | 8 | 7.3 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCC2 | 10.1021/jm058225d | ||
| 44311528 | 202441 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 633 | 12 | 2 | 10 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70487 | 202441 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 633 | 12 | 2 | 10 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C2CC2)nc1OCCOC(=O)Nc1ccccn1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10650546 | 12014 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 562 | 7 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC2c3ccccc3-c3ccccc32)cc1 | 10.1021/jm990171i | ||
| CHEMBL1184091 | 12014 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 562 | 7 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC2c3ccccc3-c3ccccc32)cc1 | 10.1021/jm990171i | ||
| CHEMBL332144 | 12014 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 562 | 7 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC2c3ccccc3-c3ccccc32)cc1 | 10.1021/jm990171i | ||
| 44327656 | 141257 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 977 | 25 | 9 | 8 | 4.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(F)(F)F)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL386181 | 141257 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 977 | 25 | 9 | 8 | 4.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(F)(F)F)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 10918533 | 102370 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 536 | 8 | 1 | 6 | 6.8 | CC(C)Oc1ccc2c(c1)C(c1ccc(OCc3ccccc3)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL305577 | 102370 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 536 | 8 | 1 | 6 | 6.8 | CC(C)Oc1ccc2c(c1)C(c1ccc(OCc3ccccc3)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 10674095 | 113014 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 544 | 9 | 1 | 6 | 5.1 | CCc1cccc(CC)c1N(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL332093 | 113014 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 544 | 9 | 1 | 6 | 5.1 | CCc1cccc(CC)c1N(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 8260 | 527 | 46 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 9912992 | 527 | 46 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL3989834 | 527 | 46 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 479 | 8 | 1 | 9 | 3.9 | COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cn1)C)c1ccncc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10578853 | 103117 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 564 | 10 | 1 | 11 | 3.4 | COC(=O)COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| CHEMBL308646 | 103117 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 564 | 10 | 1 | 11 | 3.4 | COC(=O)COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| CHEMBL1793926 | 207187 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | 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)N(C)C(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||||
| CHEMBL318020 | 209463 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 10504689 | 9350 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 474 | 6 | 1 | 8 | 3.6 | COC(=O)c1cccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)c1 | 10.1021/jm9606507 | ||
| CHEMBL11176 | 9350 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 474 | 6 | 1 | 8 | 3.6 | COC(=O)c1cccc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)c1 | 10.1021/jm9606507 | ||
| 10895198 | 100486 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2cccc(OCCC)c21 | 10.1021/jm010382z | ||
| CHEMBL294123 | 100486 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 426 | 9 | 1 | 6 | 5.0 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2cccc(OCCC)c21 | 10.1021/jm010382z | ||
| 10814318 | 9063 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 472 | 14 | 1 | 5 | 4.7 | C=CCCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL110064 | 9063 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 472 | 14 | 1 | 5 | 4.7 | C=CCCC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 44439102 | 89868 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.2 | CN(Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1ccno1)C(=O)CC(C)(C)C | 10.1016/j.bmcl.2006.10.009 | ||
| CHEMBL238539 | 89868 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.2 | CN(Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1ccno1)C(=O)CC(C)(C)C | 10.1016/j.bmcl.2006.10.009 | ||
| 10305181 | 60128 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 666 | 11 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)NC1CCCCC1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL175278 | 60128 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 666 | 11 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)NC1CCCCC1 | 10.1016/s0960-894x(02)01084-3 | ||
| 23445498 | 204973 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 426 | 4 | 1 | 5 | 4.9 | Cc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL89688 | 204973 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 426 | 4 | 1 | 5 | 4.9 | Cc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(96)00496-9 | ||
| 44284041 | 99839 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 4.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL289216 | 99839 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 4.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 11801523 | 8172 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 588 | 16 | 1 | 7 | 5.3 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCC)cc1 | 10.1021/jm970101g | ||
| CHEMBL109242 | 8172 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 588 | 16 | 1 | 7 | 5.3 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OCCC)cc1 | 10.1021/jm970101g | ||
| 15453170 | 104422 | 4 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311258 | 104422 | 4 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 328 | 4 | 1 | 4 | 3.8 | Cc1noc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10916597 | 201624 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL64832 | 201624 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.4 | CCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL2370254 | 208073 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 44291583 | 100920 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 500 | 8 | 3 | 9 | 2.9 | COc1cc(OC)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C(N)=O)c1 | 10.1021/jm9608366 | ||
| CHEMBL297215 | 100920 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 500 | 8 | 3 | 9 | 2.9 | COc1cc(OC)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C(N)=O)c1 | 10.1021/jm9608366 | ||
| CHEMBL336033 | 209828 | 1 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1021/jm00021a021 | ||||
| 23445285 | 111884 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 454 | 7 | 1 | 5 | 5.6 | CCCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL329560 | 111884 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 454 | 7 | 1 | 5 | 5.6 | CCCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| 58688006 | 170550 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 524 | 13 | 2 | 9 | 3.8 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4458005 | 170550 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 524 | 13 | 2 | 9 | 3.8 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10165809 | 131277 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 541 | 9 | 2 | 11 | 2.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL369362 | 131277 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 541 | 9 | 2 | 11 | 2.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 137637038 | 155400 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 581 | 11 | 2 | 9 | 5.0 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4061110 | 155400 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 581 | 11 | 2 | 9 | 5.0 | CCCCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10577255 | 174846 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 8 | 2 | 6 | 5.2 | CCCCc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL45760 | 174846 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 8 | 2 | 6 | 5.2 | CCCCc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| 10576378 | 100654 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1ccccc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Br | 10.1021/jm9608366 | ||
| CHEMBL295207 | 100654 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1ccccc1NC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Br | 10.1021/jm9608366 | ||
| 10623888 | 162608 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 461 | 8 | 1 | 6 | 3.4 | CCCCS(=O)(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL417971 | 162608 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 461 | 8 | 1 | 6 | 3.4 | CCCCS(=O)(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 10230835 | 109744 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 12 | 1 | 7 | 4.0 | CCCS(=O)(=O)N(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)CC(C)C | 10.1021/jm970101g | ||
| CHEMBL323789 | 109744 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 12 | 1 | 7 | 4.0 | CCCS(=O)(=O)N(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)CC(C)C | 10.1021/jm970101g | ||
| 10344914 | 99675 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 7 | 3 | 7 | 4.1 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL287711 | 99675 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 7 | 3 | 7 | 4.1 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 9936145 | 18837 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 510 | 11 | 1 | 4 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL128818 | 18837 | 1 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 510 | 11 | 1 | 4 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(C)c(F)c1 | 10.1021/jm010237l | ||
| 10577829 | 9576 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 518 | 13 | 1 | 7 | 3.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1OCCCO1 | 10.1021/jm980217s | ||
| CHEMBL112877 | 9576 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 518 | 13 | 1 | 7 | 3.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC1OCCCO1 | 10.1021/jm980217s | ||
| 10278777 | 167569 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL432974 | 167569 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 502 | 14 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| 44322947 | 204974 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL89689 | 204974 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 428 | 5 | 1 | 6 | 4.3 | COc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| 11798998 | 205108 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9050 | 205108 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.9 | CCCCCN(C)C(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 21041284 | 170370 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 568 | 13 | 2 | 9 | 3.9 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4455360 | 170370 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 568 | 13 | 2 | 9 | 3.9 | CCCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44334065 | 167259 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 5 | 4.7 | COc1ccc([C@@H]2c3nc(C4CC4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL430695 | 167259 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 5 | 4.7 | COc1ccc([C@@H]2c3nc(C4CC4)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44334146 | 167437 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 446 | 7 | 2 | 6 | 4.6 | CCCNc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL432012 | 167437 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 446 | 7 | 2 | 6 | 4.6 | CCCNc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44311285 | 101829 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 635 | 13 | 2 | 10 | 6.4 | CCCc1nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c(Oc2ccccc2OC)c(OCCOC(=O)Nc2ccccn2)n1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL303428 | 101829 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 635 | 13 | 2 | 10 | 6.4 | CCCc1nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c(Oc2ccccc2OC)c(OCCOC(=O)Nc2ccccn2)n1 | 10.1016/S0960-894X(97)00400-9 | ||
| 159594 | 518 | 38 | None | -4073 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm990171i | ||
| 3487 | 518 | 38 | None | -4073 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm990171i | ||
| CHEMBL9194 | 518 | 38 | None | -4073 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm990171i | ||
| DB06199 | 518 | 38 | None | -4073 | 3 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm990171i | ||
| 44327881 | 161126 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1044 | 26 | 9 | 8 | 6.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| CHEMBL413179 | 161126 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1044 | 26 | 9 | 8 | 6.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||
| 10597575 | 6818 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 408 | 5 | 1 | 6 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCC2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10843 | 6818 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 408 | 5 | 1 | 6 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2CC2CCCC2)cc1 | 10.1021/jm9606507 | ||
| 10576377 | 11902 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1cccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| CHEMBL1183291 | 11902 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1cccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| CHEMBL288967 | 11902 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 471 | 6 | 2 | 7 | 3.9 | COc1cccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| 10503525 | 5790 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10794 | 5790 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 446 | 6 | 1 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3cc(OC)c4c(c3)OCO4)=C2Cc2ccccc2)cc1 | 10.1021/jm9606507 | ||
| 44368414 | 120774 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 459 | 9 | 1 | 5 | 4.2 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2ccccc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL357978 | 120774 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 459 | 9 | 1 | 5 | 4.2 | COc1ccc(CN(C(=O)/C=C/c2ccc3c(c2)OCO3)C(Cc2ccccc2)C(=O)O)cc1 | 10.1016/s0960-894x(01)00009-9 | ||
| 44371396 | 49253 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3SC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL156532 | 49253 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 471 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3SC)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 10992620 | 201659 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 384 | 5 | 1 | 6 | 3.8 | COC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL65070 | 201659 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 384 | 5 | 1 | 6 | 3.8 | COC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 10766067 | 9646 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.3 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL113379 | 9646 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.3 | CCCN(C)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 44213924 | 205763 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 567 | 7 | 1 | 7 | 4.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)N2N=C(c3ccc(Cl)cc3)CCC2=O)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL94426 | 205763 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 567 | 7 | 1 | 7 | 4.8 | CC(C)c1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)N2N=C(c3ccc(Cl)cc3)CCC2=O)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 10289311 | 109946 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 514 | 13 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)C=C(C)C | 10.1021/jm980217s | ||
| CHEMBL324586 | 109946 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 514 | 13 | 1 | 5 | 5.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)C=C(C)C | 10.1021/jm980217s | ||
| 23445388 | 204798 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL88506 | 204798 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2sccc2-c2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 44333598 | 108703 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 6 | 4.6 | CCCOc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL321520 | 108703 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 6 | 4.6 | CCCOc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 22009947 | 84920 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261358 | 84920 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL413825 | 211339 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(95)00084-7 | ||||
| 10602726 | 165233 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 549 | 10 | 4 | 5 | 5.1 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(C2CC2)o1 | 10.1021/jm950591h | ||
| CHEMBL424764 | 165233 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 549 | 10 | 4 | 5 | 5.1 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(C2CC2)o1 | 10.1021/jm950591h | ||
| 10506524 | 60852 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 536 | 9 | 4 | 5 | 4.2 | CNC(=O)c1nc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)oc1C | 10.1021/jm950592+ | ||
| CHEMBL176565 | 60852 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 536 | 9 | 4 | 5 | 4.2 | CNC(=O)c1nc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)oc1C | 10.1021/jm950592+ | ||
| 9806559 | 9061 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 515 | 13 | 1 | 6 | 3.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCC1=O | 10.1021/jm980217s | ||
| CHEMBL110053 | 9061 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 515 | 13 | 1 | 6 | 3.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCC1=O | 10.1021/jm980217s | ||
| 71456864 | 81280 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 618 | 13 | 2 | 12 | 3.0 | CCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| CHEMBL2163718 | 81280 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 618 | 13 | 2 | 12 | 3.0 | CCNS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(Br)cn2)c1Oc1ccccc1OC | 10.1021/jm3009103 | ||
| 10233400 | 128163 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccncc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL366885 | 128163 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1ccncc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10651146 | 108377 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 596 | 12 | 1 | 8 | 4.4 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL321035 | 108377 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 596 | 12 | 1 | 8 | 4.4 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 10415067 | 45109 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 546 | 8 | 2 | 6 | 5.0 | O=C(O)C(Cc1c[nH]c2ccccc12)N(Cc1cc2c(cc1Cl)OCO2)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152713 | 45109 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 546 | 8 | 2 | 6 | 5.0 | O=C(O)C(Cc1c[nH]c2ccccc12)N(Cc1cc2c(cc1Cl)OCO2)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| 44371531 | 164313 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 6.3 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3C(C)C)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL422002 | 164313 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 467 | 6 | 1 | 5 | 6.3 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3C(C)C)c3c2oc2ccccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 10433234 | 203736 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 436 | 5 | 1 | 4 | 4.3 | CCCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80342 | 203736 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 436 | 5 | 1 | 4 | 4.3 | CCCc1ccc(Br)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL2369714 | 207911 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 44368482 | 44432 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 523 | 8 | 2 | 7 | 4.2 | O=C(O)C(Cc1ccc(O)cc1)N(Cc1cc2c(cc1Cl)OCO2)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152091 | 44432 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 523 | 8 | 2 | 7 | 4.2 | O=C(O)C(Cc1ccc(O)cc1)N(Cc1cc2c(cc1Cl)OCO2)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| 44386143 | 130170 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 571 | 9 | 3 | 6 | 5.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368360 | 130170 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 571 | 9 | 3 | 6 | 5.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCc3ccccc32)nc1C(=O)O | 10.1021/jm950592+ | ||
| 44385490 | 131286 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 532 | 10 | 4 | 7 | 4.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccn2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL369386 | 131286 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 532 | 10 | 4 | 7 | 4.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)Nc2ccccn2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 23445544 | 61046 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.1 | Cc1ccc(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL176912 | 61046 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 438 | 5 | 1 | 5 | 5.1 | Cc1ccc(/C=C/c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44266640 | 97666 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 459 | 4 | 1 | 8 | 4.2 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc3c(cc2n1Cc1ccc2c(c1)OCO2)OCO3 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL273529 | 97666 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 459 | 4 | 1 | 8 | 4.2 | O=C(O)c1c(-c2ccc3c(c2)OCO3)c2cc3c(cc2n1Cc1ccc2c(c1)OCO2)OCO3 | 10.1016/0960-894X(96)00170-9 | ||
| 44368416 | 44440 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 540 | 8 | 2 | 6 | 5.6 | O=C(O)C(Cc1c[nH]c2ccccc12)N(Cc1cc2c(cc1Cl)OCO2)Cc1cc2c(cc1Cl)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152098 | 44440 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 540 | 8 | 2 | 6 | 5.6 | O=C(O)C(Cc1c[nH]c2ccccc12)N(Cc1cc2c(cc1Cl)OCO2)Cc1cc2c(cc1Cl)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| 18996000 | 98893 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 491 | 9 | 1 | 7 | 6.1 | CCCOc1ccc2c(Sc3cccc(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL282398 | 98893 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 491 | 9 | 1 | 7 | 6.1 | CCCOc1ccc2c(Sc3cccc(OC)c3)c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c2c1 | 10.1016/0960-894X(96)00232-6 | ||
| 18617354 | 203766 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80507 | 203766 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 384 | 3 | 1 | 4 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10648135 | 9252 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 472 | 13 | 1 | 5 | 4.7 | C/C=C/CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL111218 | 9252 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 472 | 13 | 1 | 5 | 4.7 | C/C=C/CC[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 44386621 | 60948 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL176653 | 60948 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 549 | 10 | 4 | 6 | 4.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10768346 | 131021 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 522 | 10 | 5 | 5 | 4.0 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL369202 | 131021 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 522 | 10 | 5 | 5 | 4.0 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10527774 | 183106 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 455 | 5 | 2 | 6 | 4.2 | Cc1cccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| CHEMBL48031 | 183106 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 455 | 5 | 2 | 6 | 4.2 | Cc1cccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| 10718688 | 183044 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 457 | 5 | 3 | 7 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cccc(O)c2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL48024 | 183044 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 457 | 5 | 3 | 7 | 3.6 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cccc(O)c2)c1Br | 10.1021/jm9608366 | ||
| 10548486 | 173544 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 391 | 5 | 2 | 6 | 3.7 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm9608366 | ||
| CHEMBL45456 | 173544 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 391 | 5 | 2 | 6 | 3.7 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm9608366 | ||
| 42630531 | 18302 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 543 | 9 | 2 | 7 | 5.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1272299 | 18302 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 543 | 9 | 2 | 7 | 5.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 10650638 | 9094 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 566 | 13 | 1 | 6 | 4.8 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(F)c(F)c1 | 10.1021/jm970101g | ||
| CHEMBL110305 | 9094 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 566 | 13 | 1 | 6 | 4.8 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(F)c(F)c1 | 10.1021/jm970101g | ||
| 18738878 | 193164 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 547 | 8 | 2 | 7 | 4.2 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL539420 | 193164 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 547 | 8 | 2 | 7 | 4.2 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 44266851 | 14416 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 550 | 11 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| CHEMBL10847 | 14416 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 550 | 11 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| CHEMBL1204671 | 14416 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 550 | 11 | 1 | 9 | 4.7 | COc1ccc(C(=O)/C(Cc2ccc(OC)c(OC)c2OC)=C(\C(=O)O)c2cc(OC)c3c(c2)OCO3)cc1C | 10.1021/jm9606507 | ||
| 44371450 | 48600 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(OC)c(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL155937 | 48600 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 485 | 7 | 1 | 7 | 5.2 | COc1ccc(OC)c(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2ccccc23)c1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL2370253 | 208072 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10151203 | 100333 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 5 | 1 | 6 | 4.2 | COc1ccc(Cn2c(=O)c(C(=O)O)c(-c3ccc4c(c3)OCO4)c3ccccc32)cc1 | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL293151 | 100333 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 5 | 1 | 6 | 4.2 | COc1ccc(Cn2c(=O)c(C(=O)O)c(-c3ccc4c(c3)OCO4)c3ccccc32)cc1 | 10.1016/S0960-894X(97)00319-3 | ||
| 76312118 | 84923 | 0 | None | -691 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261361 | 84923 | 0 | None | -691 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| 23445412 | 101792 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 426 | 5 | 1 | 7 | 4.3 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL303203 | 101792 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 426 | 5 | 1 | 7 | 4.3 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1016/S0960-894X(97)00367-3 | ||
| 21041297 | 169040 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 510 | 12 | 2 | 9 | 3.4 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4436531 | 169040 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 510 | 12 | 2 | 9 | 3.4 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 1011 | 3300 | 24 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 10.1016/j.bmcl.2016.06.014 | ||
| 5312146 | 3300 | 24 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL1628620 | 3300 | 24 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 609 | 12 | 3 | 10 | 4.8 | OC[C@H](COc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)OC)O | 10.1016/j.bmcl.2016.06.014 | ||
| 11015645 | 201497 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 438 | 9 | 1 | 5 | 6.1 | CCCCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL64282 | 201497 | 0 | None | - | 0 | Pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 438 | 9 | 1 | 5 | 6.1 | CCCCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 18738879 | 89802 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 548 | 8 | 2 | 7 | 4.8 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)O)cc21 | 10.1007/s00044-004-0021-y | ||
| CHEMBL23833 | 89802 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 548 | 8 | 2 | 7 | 4.8 | CCn1cc(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)c2ccc(C(=O)O)cc21 | 10.1007/s00044-004-0021-y | ||
| 18995996 | 98745 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 6.9 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OCc4ccccc4)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL281451 | 98745 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 569 | 10 | 1 | 8 | 6.9 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OCc4ccccc4)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 10971076 | 201175 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 386 | 3 | 1 | 4 | 4.7 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL62585 | 201175 | 0 | None | - | 0 | Pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 386 | 3 | 1 | 4 | 4.7 | Cc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccccc32)cc1 | 10.1021/jm010382z | ||
| 10627378 | 60102 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 598 | 11 | 5 | 4 | 5.6 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(Cc2ccccc2)[nH]1 | 10.1021/jm950591h | ||
| CHEMBL175103 | 60102 | 0 | None | - | 0 | Pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 598 | 11 | 5 | 4 | 5.6 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(Cc2ccccc2)[nH]1 | 10.1021/jm950591h | ||
| 10815168 | 167588 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 5 | 2 | 6 | 5.2 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(C(C)(C)C)cc2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL433074 | 167588 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 497 | 5 | 2 | 6 | 5.2 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(C(C)(C)C)cc2)c1Br | 10.1021/jm9608366 | ||
| 137647152 | 157108 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 581 | 10 | 2 | 9 | 4.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4081426 | 157108 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 581 | 10 | 2 | 9 | 4.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10745942 | 9221 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 13 | 1 | 8 | 4.3 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc2c(c1)OCCO2 | 10.1021/jm970101g | ||
| CHEMBL111010 | 9221 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 588 | 13 | 1 | 8 | 4.3 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc2c(c1)OCCO2 | 10.1021/jm970101g | ||
| 11050177 | 10162 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 585 | 10 | 1 | 9 | 6.1 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3ccco3)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL116108 | 10162 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 585 | 10 | 1 | 9 | 6.1 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3ccco3)cn2)cc1 | 10.1021/jm0102304 | ||
| CHEMBL175501 | 10162 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 585 | 10 | 1 | 9 | 6.1 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(-c3ccco3)cn2)cc1 | 10.1021/jm0102304 | ||
| 9853680 | 98195 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 771 | 17 | 2 | 14 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL277275 | 98195 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 771 | 17 | 2 | 14 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2cc(OC)c(OC)c(OC)c2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44314580 | 203427 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 608 | 13 | 5 | 5 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL78023 | 203427 | 0 | None | - | 0 | Pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 608 | 13 | 5 | 5 | 4.5 | CCCCC(NC(=O)[C@@H](Cc1c(C#N)[nH]c2ccccc12)NC(=O)C(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(C)C(C)C)C(=O)O | 10.1021/jm9600914 | ||
| 10697520 | 12011 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 530 | 10 | 2 | 6 | 4.9 | CCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL1184086 | 12011 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 530 | 10 | 2 | 6 | 4.9 | CCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL331936 | 12011 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 530 | 10 | 2 | 6 | 4.9 | CCCC(NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)c1ccccc1 | 10.1021/jm990171i | ||
| CHEMBL384792 | 210588 | 0 | None | - | 0 | Bovine | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H]([C@@H](C)O)NC(=O)CNC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)NC(=O)[C@H]2CCCN2C1=O | 10.1016/0960-894X(96)00127-8 | ||||
| 44314658 | 203457 | 0 | None | - | 0 | Pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 589 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CCC)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL78230 | 203457 | 0 | None | - | 0 | Pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 589 | 13 | 5 | 4 | 4.7 | CCCCC(NC(=O)[C@@H](Cc1c(Cl)[nH]c2ccccc12)NC(=O)C(CCC)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL1788127 | 209370 | 8 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| CHEMBL313760 | 209370 | 8 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| 19432649 | 202783 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCO | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL72473 | 202783 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 487 | 9 | 2 | 8 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCO | 10.1016/S0960-894X(97)00400-9 | ||
| 44311321 | 202484 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1cccnc1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70788 | 202484 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 607 | 11 | 2 | 10 | 5.7 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)Nc1cccnc1 | 10.1016/S0960-894X(97)00400-9 | ||
| 18617284 | 203497 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78552 | 203497 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 350 | 3 | 1 | 4 | 3.2 | Cc1noc(NS(=O)(=O)c2ccc(Cl)cc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 44339714 | 110820 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 500 | 14 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC/C=C(/C)CC | 10.1021/jm980217s | ||
| CHEMBL326685 | 110820 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 500 | 14 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC/C=C(/C)CC | 10.1021/jm980217s | ||
| 10138169 | 98902 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 440 | 6 | 1 | 8 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL282470 | 98902 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 440 | 6 | 1 | 8 | 3.7 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2ccc3c(c2)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL85341 | 214111 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | 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](Cc1ccc(O)cc1)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/jm00095a029 | ||||
| 44266567 | 97781 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 461 | 5 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(-c3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL274368 | 97781 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 461 | 5 | 1 | 8 | 4.5 | COc1cc2c(-c3ccc4c(c3)OCO4)c(C(=O)O)n(-c3ccc4c(c3)OCO4)c2cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| 44383536 | 119891 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 362 | 3 | 2 | 5 | 2.9 | C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| CHEMBL353502 | 119891 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 362 | 3 | 2 | 5 | 2.9 | C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| 11133491 | 101699 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 3 | 1 | 6 | 4.2 | O=C(O)C1=C(c2ccc3c(c2)OCO3)c2ccccc2OC1c1ccc2c(c1)OCO2 | 10.1021/jm010382z | ||
| CHEMBL302659 | 101699 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 3 | 1 | 6 | 4.2 | O=C(O)C1=C(c2ccc3c(c2)OCO3)c2ccccc2OC1c1ccc2c(c1)OCO2 | 10.1021/jm010382z | ||
| 11122785 | 201286 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 426 | 8 | 1 | 6 | 4.6 | COCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL63057 | 201286 | 0 | None | - | 0 | Pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 426 | 8 | 1 | 6 | 4.6 | COCCCC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 10184817 | 9483 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)CCC | 10.1021/jm980217s | ||
| CHEMBL112417 | 9483 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)CCC | 10.1021/jm980217s | ||
| 21041370 | 81590 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 636 | 13 | 2 | 10 | 4.4 | COc1ccc(Cl)c(Oc2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)c1 | 10.1021/jm3009103 | ||
| CHEMBL2165330 | 81590 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 636 | 13 | 2 | 10 | 4.4 | COc1ccc(Cl)c(Oc2c(NS(=O)(=O)NCc3ccccc3)ncnc2OCCOc2ncc(Br)cn2)c1 | 10.1021/jm3009103 | ||
| 52949155 | 18227 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 557 | 10 | 2 | 7 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1271640 | 18227 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 557 | 10 | 2 | 7 | 5.4 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC(C)C)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 11070564 | 201709 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1)O2 | 10.1021/jm010382z | ||
| CHEMBL65494 | 201709 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 460 | 7 | 1 | 6 | 5.2 | CCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc(OC)cc1)O2 | 10.1021/jm010382z | ||
| 11058202 | 201135 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 388 | 4 | 1 | 5 | 4.4 | CC(C)Oc1ccc2c(c1)C(Cl)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL62374 | 201135 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 388 | 4 | 1 | 5 | 4.4 | CC(C)Oc1ccc2c(c1)C(Cl)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 10696818 | 9559 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 502 | 15 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC(CC)CC | 10.1021/jm980217s | ||
| CHEMBL112770 | 9559 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 502 | 15 | 1 | 5 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC(CC)CC | 10.1021/jm980217s | ||
| 10814222 | 9461 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 470 | 10 | 1 | 6 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)cc2OC)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL112325 | 9461 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 470 | 10 | 1 | 6 | 3.4 | CCCN(C)C(=O)CN1C[C@H](c2ccc(OC)cc2OC)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 44291775 | 100698 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 6 | 1 | 10 | 4.1 | CC#N.Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2cc3c(cc2C#N)OCO3)c1Cl | 10.1021/jm9700068 | ||
| CHEMBL295557 | 100698 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 6 | 1 | 10 | 4.1 | CC#N.Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Cc2cc3c(cc2C#N)OCO3)c1Cl | 10.1021/jm9700068 | ||
| 23445538 | 59756 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.8 | Cc1ccc(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL173805 | 59756 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 456 | 6 | 1 | 6 | 4.8 | Cc1ccc(OCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| 9808602 | 108722 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 590 | 15 | 1 | 8 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(OC)c1 | 10.1021/jm970101g | ||
| CHEMBL321673 | 108722 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 590 | 15 | 1 | 8 | 4.5 | CCCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)c(OC)c1 | 10.1021/jm970101g | ||
| CHEMBL330144 | 209581 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C | 10.1021/jm00015a003 | ||||
| CHEMBL97431 | 214147 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 10993320 | 201291 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 6 | 1 | 6 | 4.6 | CC(C)OC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL63067 | 201291 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 6 | 1 | 6 | 4.6 | CC(C)OC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 44383592 | 59588 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.6 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| CHEMBL173059 | 59588 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 386 | 4 | 1 | 5 | 3.6 | C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)C12 | 10.1016/s0960-894x(00)00136-0 | ||
| 10625269 | 14321 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2ccc(C)cc2C)cc1 | 10.1021/jm990170q | ||
| CHEMBL120106 | 14321 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2ccc(C)cc2C)cc1 | 10.1021/jm990170q | ||
| CHEMBL411797 | 211210 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 15289331 | 99103 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3ccccc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL283648 | 99103 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 5.3 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3ccccc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 18617381 | 105201 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 300 | 3 | 1 | 4 | 3.1 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL312551 | 105201 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 300 | 3 | 1 | 4 | 3.1 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2C)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10504542 | 178983 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 4.4 | CCc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL47418 | 178983 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 469 | 6 | 2 | 6 | 4.4 | CCc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| 22998396 | 100347 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2ccsc2-c2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL293232 | 100347 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 398 | 4 | 1 | 5 | 4.3 | Cc1noc(NS(=O)(=O)c2ccsc2-c2ccccc2)c1Br | 10.1016/S0960-894X(96)00496-9 | ||
| 10604167 | 12311 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 640 | 10 | 2 | 6 | 6.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1185826 | 12311 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 640 | 10 | 2 | 6 | 6.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL434986 | 12311 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 640 | 10 | 2 | 6 | 6.4 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 10185233 | 59747 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 497 | 8 | 2 | 8 | 3.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)ncnc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173721 | 59747 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 497 | 8 | 2 | 8 | 3.8 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)ncnc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 44385576 | 130855 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 539 | 10 | 1 | 10 | 3.4 | C#CCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368929 | 130855 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 539 | 10 | 1 | 10 | 3.4 | C#CCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 11113473 | 201678 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 472 | 6 | 1 | 5 | 6.3 | CC(C)Oc1ccc2c(c1)C(c1ccc(C(C)C)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL65201 | 201678 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 472 | 6 | 1 | 5 | 6.3 | CC(C)Oc1ccc2c(c1)C(c1ccc(C(C)C)cc1)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 11798762 | 204897 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 9 | 1 | 7 | 3.1 | CCCS(=O)(=O)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8911 | 204897 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 9 | 1 | 7 | 3.1 | CCCS(=O)(=O)CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL405709 | 210829 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 10792782 | 130842 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 551 | 10 | 4 | 6 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL368847 | 130842 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 551 | 10 | 4 | 6 | 5.0 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 137638953 | 156305 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 579 | 10 | 2 | 9 | 4.6 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4071505 | 156305 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 579 | 10 | 2 | 9 | 4.6 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCC4CC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 11798109 | 12253 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 4.2 | COc1cccc(NCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| CHEMBL1185459 | 12253 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 4.2 | COc1cccc(NCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| CHEMBL416086 | 12253 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 457 | 7 | 2 | 7 | 4.2 | COc1cccc(NCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c1 | 10.1021/jm9608366 | ||
| 44314610 | 102383 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 671 | 12 | 6 | 5 | 3.9 | CC(C)CC(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)N[C@H](Cc1c(Br)[nH]c2ccccc12)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL305650 | 102383 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 671 | 12 | 6 | 5 | 3.9 | CC(C)CC(NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)N[C@H](Cc1c(Br)[nH]c2ccccc12)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| 71451525 | 81259 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 629 | 12 | 1 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| CHEMBL2163697 | 81259 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 629 | 12 | 1 | 12 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCOc1ncccn1 | 10.1021/jm3009103 | ||
| 18995999 | 98060 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 477 | 6 | 1 | 8 | 5.0 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL27617 | 98060 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 477 | 6 | 1 | 8 | 5.0 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc4c(cc23)OCO4)c1 | 10.1016/0960-894X(96)00232-6 | ||
| 10719367 | 97778 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)cc(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL274359 | 97778 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)cc(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 11826847 | 201230 | 1 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccccc1OC)O2 | 10.1021/jm010382z | ||
| CHEMBL62814 | 201230 | 1 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 474 | 8 | 1 | 6 | 5.6 | CCCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccccc1OC)O2 | 10.1021/jm010382z | ||
| CHEMBL405677 | 210827 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CC(=O)[C@@H](Cc1c[nH]c2ccccc12)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00084-7 | ||||
| 11103224 | 200966 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 510 | 14 | 1 | 6 | 7.3 | CCCCCCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL61406 | 200966 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 510 | 14 | 1 | 6 | 7.3 | CCCCCCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 44384177 | 119787 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 6 | 1 | 8 | 4.6 | Cc1noc(NS(=O)(=O)c2ccsc2COc2cc3c(cc2Cl)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL352657 | 119787 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 6 | 1 | 8 | 4.6 | Cc1noc(NS(=O)(=O)c2ccsc2COc2cc3c(cc2Cl)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| 10721344 | 7459 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 13 | 1 | 8 | 3.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCOC | 10.1021/jm970101g | ||
| CHEMBL108748 | 7459 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 548 | 13 | 1 | 8 | 3.0 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CCOC | 10.1021/jm970101g | ||
| 10144334 | 130142 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 561 | 10 | 2 | 10 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL368211 | 130142 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 561 | 10 | 2 | 10 | 4.0 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(-c2ccncc2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 11113542 | 201520 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 476 | 8 | 1 | 6 | 5.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc(OC)cc3OC)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL64398 | 201520 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 476 | 8 | 1 | 6 | 5.5 | COc1ccc(C2=C(C(=O)O)C(c3ccc(OC)cc3OC)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 44311288 | 202483 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 592 | 11 | 1 | 10 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)c1cccnc1 | 10.1016/S0960-894X(97)00400-9 | ||
| CHEMBL70781 | 202483 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 592 | 11 | 1 | 10 | 5.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(C)nc1OCCOC(=O)c1cccnc1 | 10.1016/S0960-894X(97)00400-9 | ||
| 10918390 | 19125 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 522 | 12 | 1 | 5 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| CHEMBL129060 | 19125 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 522 | 12 | 1 | 5 | 5.3 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| 44327714 | 206201 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 575 | 8 | 1 | 9 | 4.2 | COc1ccc(-c2cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)n2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL96935 | 206201 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 575 | 8 | 1 | 9 | 4.2 | COc1ccc(-c2cc(C)c(=O)n(C(C(=O)NS(=O)(=O)c3ccc(C(C)C)cc3)c3ccc4c(c3)OCO4)n2)cc1 | 10.1016/S0960-894X(96)00617-8 | ||
| 10743478 | 108781 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 484 | 12 | 1 | 4 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL321852 | 108781 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 484 | 12 | 1 | 4 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10029171 | 98310 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 505 | 6 | 2 | 7 | 3.0 | Cc1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL278109 | 98310 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 505 | 6 | 2 | 7 | 3.0 | Cc1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 10503334 | 172772 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2)c1Br | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL45269 | 172772 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2)c1Br | 10.1016/S0960-894X(97)00367-3 | ||
| 10503334 | 172772 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL45269 | 172772 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 441 | 5 | 2 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccccc2)c1Br | 10.1021/jm9608366 | ||
| 11080933 | 201721 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 454 | 10 | 1 | 6 | 5.7 | CCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL65599 | 201721 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 454 | 10 | 1 | 6 | 5.7 | CCCCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 44284041 | 99839 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 4.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL289216 | 99839 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 4.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)CO)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 11122784 | 162372 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 426 | 8 | 1 | 6 | 4.9 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| CHEMBL417413 | 162372 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 426 | 8 | 1 | 6 | 4.9 | CCCCOC1=C(C(=O)O)C(c2ccc3c(c2)OCO3)Oc2ccc(OC(C)C)cc21 | 10.1021/jm010382z | ||
| 9870830 | 204987 | 34 | None | - | 2 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL8981 | 204987 | 34 | None | - | 2 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL2369713 | 207910 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(95)00152-J | ||||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm980504w | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm980504w | ||
| 21041324 | 81252 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 542 | 11 | 2 | 8 | 3.5 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Cl)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2163690 | 81252 | 2 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 542 | 11 | 2 | 8 | 3.5 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Cl)cc1 | 10.1021/jm3009103 | ||
| 10918216 | 201154 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 508 | 7 | 1 | 6 | 6.0 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OCc4ccccc4)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL62450 | 201154 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 508 | 7 | 1 | 6 | 6.0 | COc1ccc(C2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OCc4ccccc4)cc32)cc1 | 10.1021/jm010382z | ||
| 15453177 | 203810 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL80857 | 203810 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 392 | 4 | 1 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccccc2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 14041110 | 99552 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 322 | 2 | 2 | 3 | 2.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccccc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL286808 | 99552 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 322 | 2 | 2 | 3 | 2.5 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccccc21 | 10.1016/0960-894X(95)00230-Q | ||
| 10626245 | 130640 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 539 | 10 | 2 | 8 | 5.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)OC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL368629 | 130640 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 539 | 10 | 2 | 8 | 5.5 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)OC2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 10647172 | 205039 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 449 | 6 | 1 | 5 | 4.6 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2Cc2ccc(F)cc2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9012 | 205039 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 449 | 6 | 1 | 5 | 4.6 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2Cc2ccc(F)cc2)cc1 | 10.1021/jm9505369 | ||
| 9803428 | 101734 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 442 | 5 | 1 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Cl | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL302872 | 101734 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 442 | 5 | 1 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Oc2ccc3c(c2)OCO3)c1Cl | 10.1016/S0960-894X(97)00367-3 | ||
| 10793053 | 11353 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 9 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL1180363 | 11353 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 9 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| CHEMBL123994 | 11353 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 564 | 9 | 2 | 6 | 5.2 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)NC(c2ccccc2)c2ccccc2)cc1 | 10.1021/jm990171i | ||
| 9852318 | 9523 | 5 | None | -2691 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL112624 | 9523 | 5 | None | -2691 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL1627022 | 9523 | 5 | None | -2691 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| 44334150 | 4466 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 5 | 5.0 | COc1ccc([C@@H]2c3nc(CC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102314 | 4466 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 5 | 5.0 | COc1ccc([C@@H]2c3nc(CC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1016/s0960-894x(02)00663-7 | ||
| 44371773 | 48329 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 562 | 8 | 1 | 8 | 4.6 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(N(C)S(C)(=O)=O)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| CHEMBL155708 | 48329 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 562 | 8 | 1 | 8 | 4.6 | COc1ccc(-c2c(C(=O)O)c(=O)n(Cc3ccccc3OC)c3c2oc2cc(N(C)S(C)(=O)=O)ccc23)cc1 | 10.1016/s0960-894x(99)00040-2 | ||
| 44320590 | 106079 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 556 | 10 | 2 | 9 | 4.8 | COc1ccc(Cn2nc(-c3cccs3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL314206 | 106079 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 556 | 10 | 2 | 9 | 4.8 | COc1ccc(Cn2nc(-c3cccs3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c(OCC(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL384728 | 210587 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 11733450 | 201729 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 6 | 1 | 7 | 5.0 | CCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL65658 | 201729 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 6 | 1 | 7 | 5.0 | CCCOc1ccc2c(c1)C(c1ccc3c(c1)OCO3)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL2369736 | 207919 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N(C)[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||||
| 44270524 | 97755 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 682 | 13 | 1 | 9 | 6.9 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccccc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL274243 | 97755 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 682 | 13 | 1 | 9 | 6.9 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)cc(CCC)c1OC(C(=O)NS(=O)(=O)c1ccccc1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| 44368428 | 44324 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 521 | 9 | 2 | 5 | 5.5 | O=C(O)C(Cc1ccc(O)cc1)N(Cc1ccccc1-c1ccccc1)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| CHEMBL152001 | 44324 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 521 | 9 | 2 | 5 | 5.5 | O=C(O)C(Cc1ccc(O)cc1)N(Cc1ccccc1-c1ccccc1)C(=O)/C=C/c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00009-9 | ||
| 10505771 | 162804 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL419211 | 162804 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| 10299975 | 109765 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC(C)CC | 10.1021/jm980217s | ||
| CHEMBL323791 | 109765 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 488 | 14 | 1 | 5 | 5.1 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCC(C)CC | 10.1021/jm980217s | ||
| 10505771 | 162804 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL419211 | 162804 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 56678451 | 62996 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 937 | 25 | 8 | 8 | 4.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(c1ccccc1)c1ccccc1)N(C)C(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||
| CHEMBL1793927 | 62996 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 937 | 25 | 8 | 8 | 4.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(c1ccccc1)c1ccccc1)N(C)C(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm970161m | ||
| 3795752 | 104723 | 1 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL311455 | 104723 | 1 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 320 | 3 | 1 | 4 | 3.4 | Cc1noc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10769025 | 59954 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCC(C)CC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL174171 | 59954 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 550 | 10 | 5 | 5 | 4.6 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCC(C)CC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 137649592 | 156868 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 567 | 10 | 2 | 9 | 4.6 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4078537 | 156868 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 567 | 10 | 2 | 9 | 4.6 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(-c3nnn[nH]3)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10838921 | 204623 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 494 | 7 | 1 | 6 | 4.1 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)C2CCCCC2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8736 | 204623 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 494 | 7 | 1 | 6 | 4.1 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CC(=O)N(C)C2CCCCC2)cc1 | 10.1021/jm9505369 | ||
| 10744040 | 113070 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cccc(C)c2C)cc1 | 10.1021/jm990170q | ||
| CHEMBL332231 | 113070 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cccc(C)c2C)cc1 | 10.1021/jm990170q | ||
| 9874379 | 60125 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 653 | 14 | 2 | 10 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL175268 | 60125 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 653 | 14 | 2 | 10 | 5.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(C2CC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44320419 | 106591 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 496 | 7 | 2 | 6 | 5.1 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCC(C(=O)O)CC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315805 | 106591 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 496 | 7 | 2 | 6 | 5.1 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1CCC(C(=O)O)CC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 21041267 | 81597 | 10 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 558 | 9 | 2 | 8 | 2.8 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165337 | 81597 | 10 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 558 | 9 | 2 | 8 | 2.8 | CNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| 10983992 | 19261 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| CHEMBL129740 | 19261 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 506 | 12 | 1 | 4 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)CCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)cc1 | 10.1021/jm010237l | ||
| 23445468 | 11128 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 459 | 5 | 3 | 9 | 2.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(O)nn2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL1178818 | 11128 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 459 | 5 | 3 | 9 | 2.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(O)nn2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL44615 | 11128 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 459 | 5 | 3 | 9 | 2.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(O)nn2)c1Br | 10.1021/jm9608366 | ||
| 10275056 | 112017 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 5.2 | CCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL329890 | 112017 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 5.2 | CCCc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| 10577388 | 15403 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cc(C)ccc2C)cc1 | 10.1021/jm990170q | ||
| CHEMBL122111 | 15403 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2cc(C)ccc2C)cc1 | 10.1021/jm990170q | ||
| 10602620 | 16414 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| CHEMBL123997 | 16414 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 544 | 10 | 2 | 6 | 5.4 | CCCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm990170q | ||
| 21041278 | 171211 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 554 | 12 | 2 | 9 | 3.5 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4467748 | 171211 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 554 | 12 | 2 | 9 | 3.5 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(Br)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 17869279 | 14710 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2OC)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL1207701 | 14710 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2OC)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| CHEMBL431160 | 14710 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 460 | 8 | 1 | 7 | 4.7 | COc1ccc(C(=O)/C(Cc2ccccc2OC)=C(\C(=O)O)c2ccc3nsnc3c2)cc1 | 10.1016/s0960-894x(98)00301-1 | ||
| 10576428 | 14418 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 473 | 8 | 2 | 6 | 4.3 | COc1ccc(C(=O)/C(Cc2ccc(NC(C)=O)cc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10905 | 14418 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 473 | 8 | 2 | 6 | 4.3 | COc1ccc(C(=O)/C(Cc2ccc(NC(C)=O)cc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| CHEMBL1204673 | 14418 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 473 | 8 | 2 | 6 | 4.3 | COc1ccc(C(=O)/C(Cc2ccc(NC(C)=O)cc2)=C(\C(=O)O)c2ccc3c(c2)OCO3)cc1 | 10.1021/jm9606507 | ||
| 44385586 | 61333 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 531 | 10 | 1 | 9 | 4.7 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL177143 | 61333 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 531 | 10 | 1 | 9 | 4.7 | C#CCOc1nc(-c2ccncc2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 10137382 | 181602 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 427 | 5 | 3 | 7 | 3.8 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(O)c1 | 10.1021/jm9608366 | ||
| CHEMBL47827 | 181602 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 427 | 5 | 3 | 7 | 3.8 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(O)c1 | 10.1021/jm9608366 | ||
| 44385792 | 60032 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 617 | 13 | 2 | 11 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(C2CC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL174547 | 60032 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 617 | 13 | 2 | 11 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(C2CC2)nc1OCCNS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)01083-1 | ||
| 10097589 | 204558 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 7 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCC(C(=O)O)CC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL86965 | 204558 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 7 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCC(C(=O)O)CC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 10717923 | 98240 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 439 | 5 | 2 | 6 | 4.7 | Cc1cc(C)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL277595 | 98240 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 439 | 5 | 2 | 6 | 4.7 | Cc1cc(C)c(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1 | 10.1016/S0960-894X(97)00132-7 | ||
| 11799625 | 113299 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2ccc(C)c(C)c2)cc1 | 10.1021/jm990170q | ||
| CHEMBL332431 | 113299 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 6 | 4.5 | COc1ccc([C@H]2[C@H](C(=O)O)[C@@H](c3ccc4c(c3)OCO4)CN2CC(=O)Nc2ccc(C)c(C)c2)cc1 | 10.1021/jm990170q | ||
| 71462322 | 81598 | 6 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 572 | 10 | 2 | 8 | 3.2 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL2165338 | 81598 | 6 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 572 | 10 | 2 | 8 | 3.2 | CCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1 | 10.1021/jm3009103 | ||
| CHEMBL1791280 | 207177 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(95)00152-J | ||||
| 44387111 | 165629 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 10 | 5 | 5 | 4.2 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL426413 | 165629 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 10 | 5 | 5 | 4.2 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10281606 | 129150 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 575 | 9 | 2 | 10 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL367382 | 129150 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 575 | 9 | 2 | 10 | 4.2 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCO | 10.1016/s0960-894x(02)01084-3 | ||
| 10765750 | 162609 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 3.0 | CC[S+]([O-])CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL417972 | 162609 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 3.0 | CC[S+]([O-])CCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44265906 | 96820 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCOCC(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL268902 | 96820 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 3.9 | COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)CN2CCOCC(C)C)cc1 | 10.1021/jm9505369 | ||
| 18184229 | 59296 | 0 | None | - | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL171950 | 59296 | 0 | None | - | 2 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 605 | 15 | 2 | 10 | 4.2 | CCCS(=O)(=O)NCCOc1nc(C2CC2)nc(NS(=O)(=O)c2ccc(C(C)C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL313056 | 209365 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00070a001 | ||||
| 44276947 | 106368 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 430 | 5 | 1 | 3 | 5.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc(Cl)c(Cl)c3)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144803 | 106368 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 430 | 5 | 1 | 3 | 5.2 | COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc(Cl)c(Cl)c3)c2=O)c1 | 10.1016/s0960-894x(00)00232-8 | ||
| 44327238 | 106923 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 497 | 8 | 1 | 8 | 3.1 | CCCc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL318017 | 106923 | 0 | None | - | 0 | Pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 497 | 8 | 1 | 8 | 3.1 | CCCc1ccc(=O)n(C(C(=O)NS(=O)(=O)c2ccc(C(C)C)cc2)c2ccc3c(c2)OCO3)n1 | 10.1016/S0960-894X(96)00617-8 | ||
| 44458597 | 98335 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 535 | 7 | 3 | 8 | 2.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccccc2C(=O)O)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL278349 | 98335 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 535 | 7 | 3 | 8 | 2.3 | Cn1cc(C(C(=O)NS(=O)(=O)c2ccccc2C(=O)O)c2ccc3c(c2)OCO3)c2ccc(C(N)=O)cc21 | 10.1016/s0960-894x(01)00660-6 | ||
| 10817057 | 9602 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 11 | 1 | 7 | 4.7 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1021/jm970101g | ||
| CHEMBL113087 | 9602 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 11 | 1 | 7 | 4.7 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1021/jm970101g | ||
| 10994374 | 201725 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 7 | 1 | 6 | 5.4 | COc1ccc(CC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| CHEMBL65619 | 201725 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 7 | 1 | 6 | 5.4 | COc1ccc(CC2=C(C(=O)O)C(c3ccc4c(c3)OCO4)Oc3ccc(OC(C)C)cc32)cc1 | 10.1021/jm010382z | ||
| 44298356 | 193315 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 10 | 2 | 8 | 5.7 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCC/C=N/O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| CHEMBL54703 | 193315 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 10 | 2 | 8 | 5.7 | COc1cccc(Sc2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)noc2CCC/C=N/O)c1 | 10.1016/s0960-894x(00)00366-8 | ||
| 10791823 | 9358 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)C(=O)CCC | 10.1021/jm970101g | ||
| CHEMBL111783 | 9358 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)C(=O)CCC | 10.1021/jm970101g | ||
| 10601668 | 97994 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)cc2OC)cc1 | 10.1021/jm9606507 | ||
| CHEMBL275701 | 97994 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)cc2OC)cc1 | 10.1021/jm9606507 | ||
| 44266594 | 4137 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 491 | 8 | 1 | 8 | 4.8 | COc1ccc(-c2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10019 | 4137 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 491 | 8 | 1 | 8 | 4.8 | COc1ccc(-c2c(C(=O)O)n(Cc3ccc4c(c3)OCO4)c3cc(OC)c(OC)cc23)cc1OC | 10.1016/0960-894X(96)00170-9 | ||
| 44266552 | 4446 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| CHEMBL10218 | 4446 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 5.3 | CCCOc1ccc2c(c1)c(-c1ccc3c(c1)OCO3)c(C(=O)O)n2Cc1ccc2c(c1)OCO2 | 10.1016/0960-894X(96)00170-9 | ||
| 9846065 | 170352 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 439 | 7 | 2 | 6 | 3.6 | O=S(=O)(Nc1ncnc(OCCO)c1-c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4455096 | 170352 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 439 | 7 | 2 | 6 | 3.6 | O=S(=O)(Nc1ncnc(OCCO)c1-c1ccc(Cl)cc1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 10602267 | 8501 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 529 | 13 | 1 | 6 | 3.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCCC1=O | 10.1021/jm980217s | ||
| CHEMBL109478 | 8501 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 529 | 13 | 1 | 6 | 3.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CCN1CCCCC1=O | 10.1021/jm980217s | ||
| 52949197 | 18240 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 555 | 10 | 2 | 7 | 5.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL1271746 | 18240 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 555 | 10 | 2 | 7 | 5.1 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL2304012 | 207723 | 0 | None | - | 0 | Pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC(C)[C@H]1NC(=O)[C@H](C2CCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC1=O | 10.1021/jm9600914 | ||||
| 44333578 | 4537 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 4.4 | CCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL102773 | 4537 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 5 | 1 | 5 | 4.4 | CCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 44278003 | 98811 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 449 | 8 | 1 | 6 | 5.6 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccccc3)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL28188 | 98811 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 449 | 8 | 1 | 6 | 5.6 | COc1cccc(Sc2c(C(=O)O)n(Cc3ccccc3)c3cc(OC)c(OC)cc23)c1 | 10.1016/0960-894X(96)00232-6 | ||
| CHEMBL2304005 | 207716 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | Cc1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC1=O | 10.1021/jm9600914 | ||||
| 10625738 | 168926 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 517 | 6 | 2 | 6 | 5.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(-c3ccccc3)cc2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL44321 | 168926 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 517 | 6 | 2 | 6 | 5.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(-c3ccccc3)cc2)c1Br | 10.1021/jm9608366 | ||
| 44385522 | 59314 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 642 | 13 | 2 | 11 | 4.2 | CCS(=O)(=O)NCCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL172029 | 59314 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 642 | 13 | 2 | 11 | 4.2 | CCS(=O)(=O)NCCOc1nc(-c2ncccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 44284329 | 99946 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 5.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL290181 | 99946 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 5.4 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(OC(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 159594 | 518 | 38 | None | -4073 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| 3487 | 518 | 38 | None | -4073 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| CHEMBL9194 | 518 | 38 | None | -4073 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| DB06199 | 518 | 38 | None | -4073 | 3 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 10.1021/jm010237l | ||
| 10576427 | 5298 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 6 | 2 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL10697 | 5298 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 473 | 6 | 2 | 7 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(NC(C)=O)cc2)cc1 | 10.1021/jm9606507 | ||
| 11037806 | 201136 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 456 | 10 | 2 | 7 | 4.3 | CC(C)Oc1ccc2c(c1)C(OCCCCCO)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| CHEMBL62376 | 201136 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 456 | 10 | 2 | 7 | 4.3 | CC(C)Oc1ccc2c(c1)C(OCCCCCO)=C(C(=O)O)C(c1ccc3c(c1)OCO3)O2 | 10.1021/jm010382z | ||
| 3370402 | 105311 | 4 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 252 | 3 | 1 | 4 | 2.1 | Cc1noc(NS(=O)(=O)c2ccccc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL312670 | 105311 | 4 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 252 | 3 | 1 | 4 | 2.1 | Cc1noc(NS(=O)(=O)c2ccccc2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10670664 | 205586 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 438 | 8 | 2 | 6 | 2.6 | C=CCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9342 | 205586 | 0 | None | - | 0 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 438 | 8 | 2 | 6 | 2.6 | C=CCNC(=O)CN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 23445304 | 130824 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 484 | 6 | 1 | 7 | 4.4 | Cc1cc2c(cc1CCc1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL368780 | 130824 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 484 | 6 | 1 | 7 | 4.4 | Cc1cc2c(cc1CCc1sccc1S(=O)(=O)Nc1onc(C)c1Br)OCO2 | 10.1016/S0960-894X(97)00133-9 | ||
| 44320315 | 106574 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 496 | 7 | 2 | 7 | 5.0 | O=C(O)c1cccc(Cn2nc(-c3cccs3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL315638 | 106574 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 496 | 7 | 2 | 7 | 5.0 | O=C(O)c1cccc(Cn2nc(-c3cccs3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44279413 | 99490 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 400 | 2 | 2 | 3 | 3.3 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(Br)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| CHEMBL286395 | 99490 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 400 | 2 | 2 | 3 | 3.3 | O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(Br)cc21 | 10.1016/0960-894X(95)00230-Q | ||
| 9831527 | 128960 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 698 | 14 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL367274 | 128960 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 698 | 14 | 2 | 12 | 4.1 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)nc(N2CCOCC2)nc1OCCNS(=O)(=O)c1ccc(C)cc1 | 10.1016/s0960-894x(02)01083-1 | ||
| 44334129 | 108067 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 459 | 8 | 1 | 5 | 5.5 | CCCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL320208 | 108067 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 459 | 8 | 1 | 5 | 5.5 | CCCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 10230836 | 8821 | 0 | None | - | 0 | Pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 546 | 13 | 1 | 7 | 4.1 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| CHEMBL109765 | 8821 | 0 | None | - | 0 | Pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 546 | 13 | 1 | 7 | 4.1 | CCCCS(=O)(=O)N(CCC)CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm970101g | ||
| 44284288 | 99673 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 9 | 2 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)C(=O)N(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| CHEMBL287683 | 99673 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 559 | 9 | 2 | 7 | 4.9 | COc1ccc([C@@H]2c3nc(NC(C)C)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)c(CC(C)C(=O)N(C)C)c1 | 10.1016/j.bmcl.2004.01.008 | ||
| 44320375 | 106661 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 506 | 8 | 1 | 7 | 5.3 | COc1cc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)cc(OC)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL316187 | 106661 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 506 | 8 | 1 | 7 | 5.3 | COc1cc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)cc(OC)c1 | 10.1016/s0960-894x(00)00513-8 | ||
| 44320480 | 105478 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 5.4 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccco2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL312979 | 105478 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 442 | 6 | 1 | 6 | 5.4 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccco2)nn1CC1CCCCC1 | 10.1016/s0960-894x(00)00513-8 | ||
| 17885920 | 204715 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 502 | 7 | 2 | 7 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCCC(C(=O)O)C1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL88011 | 204715 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 502 | 7 | 2 | 7 | 5.2 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2cccs2)nn1CC1CCCC(C(=O)O)C1 | 10.1016/s0960-894x(00)00513-8 | ||
| 155542285 | 172508 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 522 | 14 | 2 | 11 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1Oc1cccc(OC)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4519822 | 172508 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 522 | 14 | 2 | 11 | 2.9 | CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1Oc1cccc(OC)c1 | 10.1016/j.bmcl.2016.06.014 | ||
| 44270498 | 98467 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 702 | 13 | 1 | 10 | 7.2 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(CC(C)C)s1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL279419 | 98467 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 702 | 13 | 1 | 10 | 7.2 | CCCc1cc(Cn2c(CC)nc3c(C)cc(C)nc32)ccc1OC(C(=O)NS(=O)(=O)c1ccc(CC(C)C)s1)c1ccc2c(c1)OCO2 | 10.1016/0960-894X(95)00186-W | ||
| CHEMBL265116 | 208890 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00015a003 | ||||
| 10722385 | 100033 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 606 | 13 | 1 | 11 | 4.6 | COC(=O)CCCCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| CHEMBL291058 | 100033 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 606 | 13 | 1 | 11 | 4.6 | COC(=O)CCCCOc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OC)cc2)cc(OC)c1OC | 10.1021/jm980504w | ||
| 9894460 | 204982 | 6 | None | - | 3 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL313871 | 204982 | 6 | None | - | 3 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/S0960-894X(96)00617-8 | ||
| CHEMBL8978 | 204982 | 6 | None | - | 3 | Pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/S0960-894X(96)00617-8 | ||
| 10410546 | 9322 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(CC2=C(c3ccc(OC)cc3)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL11162 | 9322 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 432 | 7 | 1 | 6 | 4.1 | COc1ccc(CC2=C(c3ccc(OC)cc3)C(=O)OC2(O)c2ccc(OC)cc2)cc1 | 10.1021/jm9606507 | ||
| 44316993 | 203231 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 286 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL76360 | 203231 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 286 | 3 | 1 | 4 | 2.7 | Cc1noc(NS(=O)(=O)c2cccc(Cl)c2)c1C | 10.1016/0960-894X(96)00441-6 | ||
| 10627398 | 130165 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 599 | 11 | 4 | 5 | 5.8 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(Cc2ccccc2)o1 | 10.1021/jm950591h | ||
| CHEMBL368339 | 130165 | 0 | None | - | 0 | Pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 599 | 11 | 4 | 5 | 5.8 | CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)O)c(Cc2ccccc2)o1 | 10.1021/jm950591h | ||
| 9959298 | 60191 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 552 | 10 | 2 | 7 | 5.4 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)N(C)C2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| CHEMBL175698 | 60191 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 552 | 10 | 2 | 7 | 5.4 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)OC(=O)N(C)C2CCCCC2)nc1C(=O)O | 10.1021/jm9505932 | ||
| 10764220 | 205355 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 413 | 8 | 1 | 6 | 3.3 | CCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL9189 | 205355 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 413 | 8 | 1 | 6 | 3.3 | CCOCCN1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)O)[C@H]1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 44384966 | 59682 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 9 | 1 | 9 | 4.8 | C#CCOc1nc(-c2cnccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173465 | 59682 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 545 | 9 | 1 | 9 | 4.8 | C#CCOc1nc(-c2cnccn2)nc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01084-3 | ||
| 22467234 | 84929 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 534 | 7 | 1 | 8 | 4.1 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(C)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261599 | 84929 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 534 | 7 | 1 | 8 | 4.1 | COc1cc(C)ccc1S(=O)(=O)NC(=O)C(c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(C)=O)ccc12 | 10.1007/s00044-004-0021-y | ||
| 11799541 | 180687 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 499 | 8 | 3 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CCCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL47620 | 180687 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 499 | 8 | 3 | 9 | 3.4 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CCCO)OCO3)c1Cl | 10.1021/jm9608366 | ||
| CHEMBL289687 | 209130 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | 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]cn1)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/jm00070a001 | ||||
| 10695071 | 100689 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 6 | 4.3 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9700068 | ||
| CHEMBL295477 | 100689 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 6 | 4.3 | Cc1ccc(CC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9700068 | ||
| CHEMBL289687 | 209130 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | 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]cn1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(95)00152-J | ||||
| 10599879 | 100806 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 5 | 2 | 6 | 4.2 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| CHEMBL296326 | 100806 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 5 | 2 | 6 | 4.2 | Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1021/jm9608366 | ||
| 25211074 | 18299 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| CHEMBL1272244 | 18299 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 543 | 10 | 2 | 7 | 5.1 | CCCOc1ccc2c(c1)c(=O)c(Cc1cccc(C(=O)O)c1)c(C(=O)O)n2Cc1cc2c(cc1CC)OCO2 | 10.1016/j.bmcl.2010.08.074 | ||
| 9871561 | 174228 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 527 | 10 | 2 | 8 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cc2)nc(C(F)(F)F)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4562189 | 174228 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 527 | 10 | 2 | 8 | 4.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cc2)nc(C(F)(F)F)nc1OCCO | 10.1016/j.bmcl.2016.06.014 | ||
| 10168597 | 61008 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cccnc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL176741 | 61008 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 661 | 11 | 2 | 13 | 3.6 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(N2CCOCC2)nc1OCC#CCOC(=O)Nc1cccnc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 44213278 | 106366 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1ccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| CHEMBL3144799 | 106366 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 3.6 | COc1ccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc4c(c3)OCO4)c2=O)cc1 | 10.1016/s0960-894x(00)00232-8 | ||
| 23445404 | 100444 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 456 | 5 | 1 | 7 | 4.1 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00367-3 | ||
| CHEMBL293877 | 100444 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 456 | 5 | 1 | 7 | 4.1 | Cc1ccc(OC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00367-3 | ||
| 10621170 | 11136 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 402 | 5 | 2 | 8 | 3.0 | Cc1cc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)no1 | 10.1021/jm9608366 | ||
| CHEMBL1178890 | 11136 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 402 | 5 | 2 | 8 | 3.0 | Cc1cc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)no1 | 10.1021/jm9608366 | ||
| CHEMBL48120 | 11136 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 402 | 5 | 2 | 8 | 3.0 | Cc1cc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)no1 | 10.1021/jm9608366 | ||
| 23445256 | 59873 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 470 | 6 | 1 | 7 | 4.1 | Cc1noc(NS(=O)(=O)c2ccsc2CCc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL173982 | 59873 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 470 | 6 | 1 | 7 | 4.1 | Cc1noc(NS(=O)(=O)c2ccsc2CCc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 44340049 | 109842 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 500 | 13 | 1 | 5 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| CHEMBL323951 | 109842 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 500 | 13 | 1 | 5 | 5.3 | C/C=C\C(C)(C)C[C@H]1[C@H](C(=O)O)[C@@H](c2ccc3c(c2)OCO3)CN1CC(=O)N(CCCC)CCCC | 10.1021/jm980217s | ||
| 10383884 | 203498 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 359 | 4 | 2 | 5 | 2.9 | CNc1ccc(C)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL78563 | 203498 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 359 | 4 | 2 | 5 | 2.9 | CNc1ccc(C)cc1S(=O)(=O)Nc1onc(C)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10673644 | 9689 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL113611 | 9689 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 76324075 | 85413 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 340 | 4 | 1 | 6 | 4.0 | Cc1c(C(=O)O)oc2cccc(OCc3ccc4nsnc4c3)c12 | 10.1007/s00044-013-0542-3 | ||
| CHEMBL2296899 | 85413 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 340 | 4 | 1 | 6 | 4.0 | Cc1c(C(=O)O)oc2cccc(OCc3ccc4nsnc4c3)c12 | 10.1007/s00044-013-0542-3 | ||
| CHEMBL315658 | 209445 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/S0960-894X(01)81215-4 | ||||
| CHEMBL315658 | 209445 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)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/jm00070a001 | ||||
| 9809270 | 130818 | 0 | None | - | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 622 | 14 | 2 | 12 | 2.3 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| CHEMBL368738 | 130818 | 0 | None | - | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 622 | 14 | 2 | 12 | 2.3 | CCCS(=O)(=O)NCCOc1nc(N2CCOCC2)nc(NS(=O)(=O)c2ccc(C)cn2)c1Oc1ccccc1OC | 10.1016/s0960-894x(02)01083-1 | ||
| 137643691 | 157713 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 10 | 2 | 7 | 5.5 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4088634 | 157713 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 10 | 2 | 7 | 5.5 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(C(=O)O)c3)c(=O)c3cc(OCC4CCC4)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 23445272 | 127228 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 4.7 | Cc1ccc(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL366364 | 127228 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 6 | 1 | 5 | 4.7 | Cc1ccc(CCc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(97)00133-9 | ||
| 44458670 | 98595 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 521 | 7 | 2 | 8 | 2.7 | COc1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| CHEMBL280379 | 98595 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 521 | 7 | 2 | 8 | 2.7 | COc1ccc(S(=O)(=O)NC(=O)C(c2ccc3c(c2)OCO3)c2cn(C)c3cc(C(N)=O)ccc23)cc1 | 10.1016/s0960-894x(01)00660-6 | ||
| 10238141 | 194178 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 429 | 5 | 1 | 6 | 4.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2ccccc21 | 10.1016/S0960-894X(97)00319-3 | ||
| CHEMBL55853 | 194178 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 429 | 5 | 1 | 6 | 4.2 | COc1ccccc1Cn1c(=O)c(C(=O)O)c(-c2ccc3c(c2)OCO3)c2ccccc21 | 10.1016/S0960-894X(97)00319-3 | ||
| 44333887 | 108138 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 446 | 7 | 2 | 6 | 3.9 | CCNCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| CHEMBL320631 | 108138 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 446 | 7 | 2 | 6 | 3.9 | CCNCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(02)00663-7 | ||
| 18617403 | 203562 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2cccc(Br)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| CHEMBL79031 | 203562 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 394 | 3 | 1 | 4 | 3.3 | Cc1noc(NS(=O)(=O)c2cccc(Br)c2)c1Br | 10.1016/0960-894X(96)00441-6 | ||
| 10142669 | 9353 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 518 | 11 | 1 | 7 | 3.3 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CC | 10.1021/jm970101g | ||
| CHEMBL111769 | 9353 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 518 | 11 | 1 | 7 | 3.3 | CCCN(CCN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1)S(=O)(=O)CC | 10.1021/jm970101g | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.ejmech.2016.06.006 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.ejmech.2016.06.006 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.ejmech.2016.06.006 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.ejmech.2016.06.006 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.ejmech.2016.06.006 | ||
| 104865 | 698 | 94 | None | -123 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmc.2015.01.003 | ||
| 3494 | 698 | 94 | None | -123 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmc.2015.01.003 | ||
| 392 | 698 | 94 | None | -123 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmc.2015.01.003 | ||
| CHEMBL957 | 698 | 94 | None | -123 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmc.2015.01.003 | ||
| DB00559 | 698 | 94 | None | -123 | 4 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1016/j.bmc.2015.01.003 | ||
| 10790757 | 96765 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| CHEMBL268480 | 96765 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2ccc(OC)c(OC)c2)cc1 | 10.1021/jm9606507 | ||
| 11027946 | 18725 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 12 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)c(F)c1 | 10.1021/jm010237l | ||
| CHEMBL128479 | 18725 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 12 | 1 | 5 | 5.4 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(CC)c(F)c1 | 10.1021/jm010237l | ||
| 44387111 | 165629 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 548 | 10 | 5 | 5 | 4.2 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL426413 | 165629 | 0 | None | - | 0 | Pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 548 | 10 | 5 | 5 | 4.2 | Cc1[nH]c([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CC3CCC2C3)nc1C(=O)O | 10.1021/jm950592+ | ||
| 10289348 | 9223 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 516 | 16 | 1 | 5 | 5.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(CCC)CCC | 10.1021/jm980217s | ||
| CHEMBL111023 | 9223 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 516 | 16 | 1 | 5 | 5.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(CCC)CCC | 10.1021/jm980217s | ||
| 71458717 | 81258 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 433 | 9 | 2 | 10 | 1.5 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCO | 10.1021/jm3009103 | ||
| CHEMBL2163696 | 81258 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 433 | 9 | 2 | 10 | 1.5 | COc1ccccc1Oc1c(NS(C)(=O)=O)nc(-c2ncccn2)nc1OCCO | 10.1021/jm3009103 | ||
| 44320432 | 204532 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 442 | 6 | 1 | 7 | 3.6 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1OCCO1 | 10.1016/s0960-894x(00)00513-8 | ||
| CHEMBL86821 | 204532 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 442 | 6 | 1 | 7 | 3.6 | O=C(O)c1c(Cc2cc3c(cc2Cl)OCO3)c(-c2ccccc2)nn1CC1OCCO1 | 10.1016/s0960-894x(00)00513-8 | ||
| 23445523 | 59706 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 472 | 6 | 1 | 8 | 3.9 | Cc1noc(NS(=O)(=O)c2sccc2COc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| CHEMBL173557 | 59706 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 472 | 6 | 1 | 8 | 3.9 | Cc1noc(NS(=O)(=O)c2sccc2COc2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00132-7 | ||
| 22998508 | 205205 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| CHEMBL91073 | 205205 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 4.6 | Cc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1 | 10.1016/S0960-894X(96)00496-9 | ||
| 10649321 | 110457 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL326191 | 110457 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL328942 | 209570 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | 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](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00015a003 | ||||
| 10649321 | 110457 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| CHEMBL326191 | 110457 | 0 | None | - | 0 | Pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 508 | 12 | 1 | 5 | 4.9 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCC3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm960077r | ||
| 10602312 | 59351 | 0 | None | - | 0 | Pig | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 531 | 11 | 5 | 5 | 4.5 | Cc1oc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL172178 | 59351 | 0 | None | - | 0 | Pig | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 531 | 11 | 5 | 5 | 4.5 | Cc1oc([C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccccc2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 137633242 | 155939 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 10 | 2 | 10 | 3.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| CHEMBL4067475 | 155939 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 569 | 10 | 2 | 10 | 3.8 | CCc1cc2c(cc1Cn1c(C(=O)O)c(Cc3cccc(-c4nnn[nH]4)c3)c(=O)c3cc(OCOC)ccc31)OCO2 | 10.1016/j.bmcl.2017.04.049 | ||
| 10189776 | 59742 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 651 | 11 | 1 | 10 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| CHEMBL173689 | 59742 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 651 | 11 | 1 | 10 | 6.3 | COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCC#CCOc1ccccc1 | 10.1016/s0960-894x(02)01084-3 | ||
| 10766198 | 162335 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)NCc2ccccc2)c1Br | 10.1021/jm9608366 | ||
| CHEMBL417358 | 162335 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 455 | 6 | 2 | 6 | 3.5 | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)NCc2ccccc2)c1Br | 10.1021/jm9608366 | ||
| 9914310 | 204917 | 3 | None | -1995 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8923 | 204917 | 3 | None | -1995 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL315780 | 209446 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | 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](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)c1csc2ccccc12)[C@@H](C)CC | 10.1021/jm00070a001 | ||||
| 11477084 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| 216235 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| 3548 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| 3950 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| CHEMBL282724 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| DB06268 | 3553 | 46 | None | - | 2 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | 10.1021/jm9700068 | ||
| 10673644 | 9689 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| CHEMBL113611 | 9689 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 524 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1 | 10.1021/jm010237l | ||
| 16004692 | 2421 | 85 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 4809 | 2421 | 85 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 7352 | 2421 | 85 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2103873 | 2421 | 85 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| DB08932 | 2421 | 85 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | 10.1016/j.bmcl.2016.06.014 | ||
| 10070 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1016/j.bmcl.2016.06.014 | ||
| 25099191 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL2165326 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1016/j.bmcl.2016.06.014 | ||
| DB15059 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1016/j.bmcl.2016.06.014 | ||
| 10070 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1021/jm3009103 | ||
| 25099191 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1021/jm3009103 | ||
| CHEMBL2165326 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1021/jm3009103 | ||
| DB15059 | 445 | 41 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 544 | 8 | 2 | 8 | 2.5 | Brc1ccc(cc1)c1c(OCCOc2ncc(cn2)Br)ncnc1NS(=O)(=O)N | 10.1021/jm3009103 | ||
| 44314906 | 103103 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 607 | 12 | 6 | 5 | 3.4 | Cc1[nH]c2ccccc2c1C[C@@H](NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| CHEMBL308621 | 103103 | 0 | None | - | 0 | Pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 607 | 12 | 6 | 5 | 3.4 | Cc1[nH]c2ccccc2c1C[C@@H](NC(=O)C(CC(C)C)NC(=O)N1[C@@H](C)CCC[C@H]1C)C(=O)NC(Cc1c[nH]cn1)C(=O)O | 10.1021/jm9600914 | ||
| 10697377 | 60761 | 0 | None | - | 0 | Pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 523 | 10 | 4 | 6 | 4.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| CHEMBL176513 | 60761 | 0 | None | - | 0 | Pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 523 | 10 | 4 | 6 | 4.2 | Cc1oc([C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)NC2CCCC2)nc1C(=O)O | 10.1021/jm950592+ | ||
| 23445458 | 59981 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 468 | 5 | 1 | 7 | 4.5 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| CHEMBL174363 | 59981 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 468 | 5 | 1 | 7 | 4.5 | Cc1noc(NS(=O)(=O)c2sccc2/C=C/c2ccc3c(c2)OCO3)c1Br | 10.1016/S0960-894X(97)00133-9 | ||
| 44284481 | 211977 | 0 | None | 3 | 5 | Rat | 11.0 | pKi | = | 11 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| CHEMBL437472 | 211977 | 0 | None | 3 | 5 | Rat | 11.0 | pKi | = | 11 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| 131845706 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 71308726 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 995 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| CHEMBL1222310 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| CHEMBL4524099 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 131845706 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 71308726 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 995 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| CHEMBL1222310 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| CHEMBL4524099 | 3416 | 6 | None | 11 | 2 | Rat | 10.9 | pKi | = | 10.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00087a001 | ||||
| 44284481 | 211977 | 0 | None | 3 | 5 | Rat | 10.8 | pKi | = | 10.8 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| CHEMBL437472 | 211977 | 0 | None | 3 | 5 | Rat | 10.8 | pKi | = | 10.8 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| 155543936 | 172664 | 0 | None | 218776 | 2 | Rat | 10.8 | pKi | = | 10.8 | Binding | ChEMBL | 2514 | 48 | 34 | 38 | -9.8 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CC(N)=O)NC2=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00087a001 | ||
| CHEMBL4524100 | 172664 | 0 | None | 218776 | 2 | Rat | 10.8 | pKi | = | 10.8 | Binding | ChEMBL | 2514 | 48 | 34 | 38 | -9.8 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CC(N)=O)NC2=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00087a001 | ||
| CHEMBL1790180 | 207140 | 0 | None | -1 | 3 | Human | 10.8 | pKi | = | 10.8 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.ejmech.2013.01.044 | ||||
| CHEMBL1790180 | 207140 | 0 | None | 1 | 3 | Rat | 10.7 | pKi | = | 10.7 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| 155543936 | 172664 | 0 | None | 218776 | 2 | Rat | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 2514 | 48 | 34 | 38 | -9.8 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CC(N)=O)NC2=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00087a001 | ||
| CHEMBL4524100 | 172664 | 0 | None | 218776 | 2 | Rat | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 2514 | 48 | 34 | 38 | -9.8 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CC(N)=O)NC2=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm00087a001 | ||
| CHEMBL1790180 | 207140 | 0 | None | 1 | 3 | Rat | 10.4 | pKi | = | 10.4 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm00087a001 | ||||
| CHEMBL1790180 | 207140 | 0 | None | -1 | 3 | Human | 10.3 | pKi | = | 10.3 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CCc3ccc(O)cc3)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1021/jm8007618 | ||||
| 44284481 | 211977 | 0 | None | -4 | 5 | Human | 10.2 | pKi | = | 10.2 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.bmcl.2013.01.025 | ||||
| CHEMBL437472 | 211977 | 0 | None | -4 | 5 | Human | 10.2 | pKi | = | 10.2 | 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]cn1)NC(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](CO)C(=O)N[C@H]2CSSC[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC2=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/j.bmcl.2013.01.025 | ||||
| 44314783 | 165896 | 0 | None | 7943 | 2 | Pig | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1576 | 47 | 19 | 18 | 0.8 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 77282213 | 165896 | 0 | None | 7943 | 2 | Pig | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1576 | 47 | 19 | 18 | 0.8 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL427778 | 165896 | 0 | None | 7943 | 2 | Pig | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | 1576 | 47 | 19 | 18 | 0.8 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 44311728 | 103874 | 0 | None | 13 | 2 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 653 | 12 | 3 | 7 | 4.4 | C=CS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL310039 | 103874 | 0 | None | 13 | 2 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 653 | 12 | 3 | 7 | 4.4 | C=CS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311701 | 167593 | 1 | None | 213 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 564 | 10 | 3 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL433106 | 167593 | 1 | None | 213 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 564 | 10 | 3 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311700 | 102349 | 0 | None | 234 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 579 | 10 | 3 | 4 | 6.0 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccsc3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL305462 | 102349 | 0 | None | 234 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 579 | 10 | 3 | 4 | 6.0 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccsc3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311692 | 102691 | 0 | None | 3 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 667 | 13 | 3 | 7 | 4.5 | C=CCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL308102 | 102691 | 0 | None | 3 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 667 | 13 | 3 | 7 | 4.5 | C=CCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311803 | 202848 | 0 | None | 26 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 699 | 15 | 3 | 8 | 4.3 | CCOCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL72924 | 202848 | 0 | None | 26 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 699 | 15 | 3 | 8 | 4.3 | CCOCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311804 | 102544 | 0 | None | 12 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 683 | 14 | 3 | 7 | 5.1 | CCCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL306950 | 102544 | 0 | None | 12 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 683 | 14 | 3 | 7 | 5.1 | CCCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311727 | 202764 | 0 | None | 9 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 669 | 13 | 3 | 7 | 4.7 | CCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL72348 | 202764 | 0 | None | 9 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 669 | 13 | 3 | 7 | 4.7 | CCCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44314820 | 155180 | 0 | None | 380 | 2 | Pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1518 | 45 | 18 | 17 | 1.0 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 77282210 | 155180 | 0 | None | 380 | 2 | Pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1518 | 45 | 18 | 17 | 1.0 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL405377 | 155180 | 0 | None | 380 | 2 | Pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 1518 | 45 | 18 | 17 | 1.0 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 44311915 | 104312 | 0 | None | 6 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 703 | 12 | 3 | 7 | 5.4 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)c2ccccc2)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL310920 | 104312 | 0 | None | 6 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 703 | 12 | 3 | 7 | 5.4 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)c2ccccc2)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311805 | 202860 | 0 | None | 26 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 669 | 12 | 3 | 7 | 4.7 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)C(C)C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL73000 | 202860 | 0 | None | 26 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 669 | 12 | 3 | 7 | 4.7 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)C(C)C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311838 | 202912 | 0 | None | 13 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 655 | 12 | 3 | 7 | 4.3 | CCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL73373 | 202912 | 0 | None | 13 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 655 | 12 | 3 | 7 | 4.3 | CCS(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311726 | 102611 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 667 | 12 | 3 | 7 | 4.8 | C/C=C/S(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL307471 | 102611 | 0 | None | 10 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 667 | 12 | 3 | 7 | 4.8 | C/C=C/S(=O)(=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311772 | 102559 | 0 | None | 10 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 628 | 15 | 2 | 8 | 4.1 | CCCCS(=O)(=O)NC(=O)C(CCSC)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL307045 | 102559 | 0 | None | 10 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 628 | 15 | 2 | 8 | 4.1 | CCCCS(=O)(=O)NC(=O)C(CCSC)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311850 | 102716 | 0 | None | 10 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 717 | 13 | 3 | 7 | 5.5 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)Cc2ccccc2)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL308269 | 102716 | 0 | None | 10 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 717 | 13 | 3 | 7 | 5.5 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccno3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NS(=O)(=O)Cc2ccccc2)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311849 | 102599 | 0 | None | 5 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 694 | 14 | 2 | 7 | 5.8 | CCCCS(=O)(=O)NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL307384 | 102599 | 0 | None | 5 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 694 | 14 | 2 | 7 | 5.8 | CCCCS(=O)(=O)NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311852 | 102610 | 0 | None | 144 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 579 | 10 | 3 | 4 | 6.0 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3cccs3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL307470 | 102610 | 0 | None | 144 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 579 | 10 | 3 | 4 | 6.0 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3cccs3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311773 | 202972 | 0 | None | 7 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 582 | 13 | 2 | 7 | 3.8 | CCCCS(=O)(=O)NC(=O)C(CC)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL73835 | 202972 | 0 | None | 7 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 582 | 13 | 2 | 7 | 3.8 | CCCCS(=O)(=O)NC(=O)C(CC)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311699 | 202468 | 0 | None | 331 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 563 | 10 | 3 | 4 | 5.5 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccco3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL70686 | 202468 | 0 | None | 331 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 563 | 10 | 3 | 4 | 5.5 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccco3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311851 | 202957 | 0 | None | 162 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 564 | 10 | 3 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccon3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL73697 | 202957 | 0 | None | 162 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 564 | 10 | 3 | 5 | 4.9 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccon3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44314607 | 160714 | 0 | None | 1412 | 2 | Pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1534 | 46 | 19 | 18 | -0.2 | 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]cn1)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 77282208 | 160714 | 0 | None | 1412 | 2 | Pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1534 | 46 | 19 | 18 | -0.2 | 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]cn1)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL412003 | 160714 | 0 | None | 1412 | 2 | Pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1534 | 46 | 19 | 18 | -0.2 | 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]cn1)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 3887 | 2041 | 39 | None | 7 | 4 | Pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(96)00421-0 | ||||
| 5311192 | 2041 | 39 | None | 7 | 4 | Pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(96)00421-0 | ||||
| CHEMBL72410 | 2041 | 39 | None | 7 | 4 | Pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(96)00421-0 | ||||
| 44314832 | 160726 | 0 | None | 251 | 2 | Pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1496 | 45 | 18 | 17 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL412065 | 160726 | 0 | None | 251 | 2 | Pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 1496 | 45 | 18 | 17 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 3887 | 2041 | 39 | None | -7 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00387-4 | ||||
| 5311192 | 2041 | 39 | None | -7 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00387-4 | ||||
| CHEMBL72410 | 2041 | 39 | None | -7 | 4 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00387-4 | ||||
| 9938533 | 104934 | 1 | None | 1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL311854 | 104934 | 1 | None | 1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00387-4 | ||
| 9938533 | 104934 | 1 | None | 1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| CHEMBL311854 | 104934 | 1 | None | 1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| 46228117 | 198102 | 0 | None | - | 1 | Mouse | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 690 | 13 | 1 | 12 | 4.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOc3ccc(S(C)(=O)=O)cc3)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL593928 | 198102 | 0 | None | - | 1 | Mouse | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 690 | 13 | 1 | 12 | 4.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOc3ccc(S(C)(=O)=O)cc3)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| 44311763 | 202744 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 610 | 14 | 2 | 7 | 4.4 | CCCCS(=O)(=O)NC(=O)C(CC(C)C)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL72217 | 202744 | 0 | None | 6 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 610 | 14 | 2 | 7 | 4.4 | CCCCS(=O)(=O)NC(=O)C(CC(C)C)NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 9953358 | 94359 | 9 | None | -102 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| CHEMBL25344 | 94359 | 9 | None | -102 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| 9953358 | 94359 | 9 | None | -102 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL25344 | 94359 | 9 | None | -102 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10599129 | 101766 | 0 | None | -5 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 438 | 9 | 1 | 7 | 3.5 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(C)cc2)c2ccc(C)cc2)n1 | 10.1021/jm960274q | ||
| CHEMBL303034 | 101766 | 0 | None | -5 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 438 | 9 | 1 | 7 | 3.5 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(C)cc2)c2ccc(C)cc2)n1 | 10.1021/jm960274q | ||
| 10737908 | 41210 | 0 | None | -102 | 2 | Rat | 4.0 | pKi | = | 4 | Binding | ChEMBL | 370 | 6 | 1 | 4 | 4.6 | Cc1cnoc1NS(=O)(=O)c1ccccc1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| CHEMBL149060 | 41210 | 0 | None | -102 | 2 | Rat | 4.0 | pKi | = | 4 | Binding | ChEMBL | 370 | 6 | 1 | 4 | 4.6 | Cc1cnoc1NS(=O)(=O)c1ccccc1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| 10835335 | 4768 | 0 | None | -50118 | 2 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1coc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)n1 | 10.1021/jm000105c | ||
| CHEMBL104223 | 4768 | 0 | None | -50118 | 2 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1coc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)n1 | 10.1021/jm000105c | ||
| 10321341 | 144903 | 0 | None | -93 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 5.2 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm00037a003 | ||
| CHEMBL39142 | 144903 | 0 | None | -93 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 446 | 7 | 1 | 5 | 5.2 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm00037a003 | ||
| 11762890 | 100196 | 0 | None | -14791 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 8 | 2 | 9 | 5.3 | Cc1cc(NCc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)no1 | 10.1021/jm020289q | ||
| CHEMBL29223 | 100196 | 0 | None | -14791 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 8 | 2 | 9 | 5.3 | Cc1cc(NCc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)no1 | 10.1021/jm020289q | ||
| 44314444 | 161173 | 0 | None | 457 | 2 | Pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 1470 | 45 | 18 | 17 | -0.5 | 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]cn1)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL413604 | 161173 | 0 | None | 457 | 2 | Pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 1470 | 45 | 18 | 17 | -0.5 | 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]cn1)NC(=O)[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 178103 | 167388 | 9 | None | -100 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 10 | 2 | 7 | 4.6 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1OCCO)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm970101g | ||
| CHEMBL431651 | 167388 | 9 | None | -100 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 10 | 2 | 7 | 4.6 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1OCCO)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm970101g | ||
| 10763862 | 162666 | 0 | None | -1096 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 406 | 9 | 1 | 5 | 4.0 | CCc1cc(CC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL418326 | 162666 | 0 | None | -1096 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 406 | 9 | 1 | 5 | 4.0 | CCc1cc(CC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10907333 | 101612 | 0 | None | -1819 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 508 | 7 | 2 | 7 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CC(=O)NC(C)(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL30215 | 101612 | 0 | None | -1819 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 508 | 7 | 2 | 7 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CC(=O)NC(C)(C)C)c1C | 10.1021/jm020289q | ||
| 19934535 | 106492 | 0 | None | 7 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 468 | 6 | 3 | 4 | 5.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)c3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL315096 | 106492 | 0 | None | 7 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 468 | 6 | 3 | 4 | 5.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)c3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 11812665 | 99307 | 0 | None | -18197 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 467 | 8 | 1 | 7 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COC(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL285118 | 99307 | 0 | None | -18197 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 467 | 8 | 1 | 7 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COC(C)C)c1C | 10.1021/jm020289q | ||
| 178103 | 167388 | 9 | None | -100 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 10 | 2 | 7 | 4.6 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1OCCO)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm980217s | ||
| CHEMBL431651 | 167388 | 9 | None | -100 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 506 | 10 | 2 | 7 | 4.6 | CCCOc1ccc2c(c1)[C@@H](c1ccc(OC)cc1OCCO)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | 10.1021/jm980217s | ||
| 10553793 | 4395 | 0 | None | -75 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 512 | 11 | 2 | 6 | 4.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(C(=O)O)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL101742 | 4395 | 0 | None | -75 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 512 | 11 | 2 | 6 | 4.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(C(=O)O)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| 10813050 | 43803 | 0 | None | -602 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 441 | 9 | 2 | 5 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CNC=O)c1C | 10.1021/jm970872k | ||
| CHEMBL151440 | 43803 | 0 | None | -602 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 441 | 9 | 2 | 5 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CNC=O)c1C | 10.1021/jm970872k | ||
| 9830098 | 102556 | 0 | None | 5 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| CHEMBL307033 | 102556 | 0 | None | 5 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| 44312023 | 202759 | 0 | None | 22 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@H](NC(=O)[C@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| CHEMBL72295 | 202759 | 0 | None | 22 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@H](NC(=O)[C@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| 10984658 | 100384 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 570 | 10 | 1 | 7 | 6.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CCc2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL29346 | 100384 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 570 | 10 | 1 | 7 | 6.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CCc2ccccc2)c1C | 10.1021/jm020289q | ||
| 10812403 | 38863 | 0 | None | -120 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 427 | 7 | 2 | 5 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2C(N)=O)c1C | 10.1021/jm970872k | ||
| CHEMBL146904 | 38863 | 0 | None | -120 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 427 | 7 | 2 | 5 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2C(N)=O)c1C | 10.1021/jm970872k | ||
| 10668819 | 120601 | 0 | None | -602 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 402 | 6 | 1 | 4 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2F)c1C | 10.1021/jm970872k | ||
| CHEMBL357395 | 120601 | 0 | None | -602 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 402 | 6 | 1 | 4 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2F)c1C | 10.1021/jm970872k | ||
| 10742502 | 120754 | 0 | None | -134 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 457 | 9 | 3 | 6 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NCC(=O)O)c1C | 10.1021/jm970872k | ||
| CHEMBL357823 | 120754 | 0 | None | -134 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 457 | 9 | 3 | 6 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NCC(=O)O)c1C | 10.1021/jm970872k | ||
| 19934549 | 105513 | 0 | None | 3 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 439 | 6 | 2 | 3 | 5.4 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(Cc3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL313184 | 105513 | 0 | None | 3 | 2 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 439 | 6 | 2 | 3 | 5.4 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(Cc3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 10740953 | 5244 | 0 | None | -758 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 423 | 5 | 1 | 6 | 5.0 | Cc1nc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)oc1C | 10.1021/jm000105c | ||
| CHEMBL106749 | 5244 | 0 | None | -758 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 423 | 5 | 1 | 6 | 5.0 | Cc1nc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)oc1C | 10.1021/jm000105c | ||
| 10740258 | 109190 | 0 | None | -1096 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1cnc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)o1 | 10.1021/jm000105c | ||
| CHEMBL322674 | 109190 | 0 | None | -1096 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1cnc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)o1 | 10.1021/jm000105c | ||
| 9938571 | 9506 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL112531 | 9506 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL369489 | 9506 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 597 | 9 | 1 | 8 | 5.6 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| 11801906 | 98076 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 612 | 13 | 1 | 8 | 6.2 | COc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(OC)c(OC)c2)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL276288 | 98076 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 612 | 13 | 1 | 8 | 6.2 | COc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(OC)c(OC)c2)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)n1 | 10.1021/jm9910425 | ||
| 10501931 | 43625 | 0 | None | -64 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 414 | 7 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CO)c1C | 10.1021/jm970872k | ||
| CHEMBL151160 | 43625 | 0 | None | -64 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 414 | 7 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CO)c1C | 10.1021/jm970872k | ||
| 10719157 | 101825 | 0 | None | -58 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 470 | 11 | 1 | 9 | 2.9 | COc1cccc(C(OC)(c2cccc(OC)c2)C(Oc2nc(OC)cc(OC)n2)C(=O)O)c1 | 10.1021/jm960274q | ||
| CHEMBL303390 | 101825 | 0 | None | -58 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 470 | 11 | 1 | 9 | 2.9 | COc1cccc(C(OC)(c2cccc(OC)c2)C(Oc2nc(OC)cc(OC)n2)C(=O)O)c1 | 10.1021/jm960274q | ||
| 10552683 | 201421 | 0 | None | -5 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 478 | 9 | 1 | 7 | 4.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)n1 | 10.1021/jm960274q | ||
| CHEMBL64009 | 201421 | 0 | None | -5 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 478 | 9 | 1 | 7 | 4.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)n1 | 10.1021/jm960274q | ||
| 10670662 | 201756 | 0 | None | -53 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 438 | 9 | 1 | 7 | 3.5 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2cccc(C)c2)c2cccc(C)c2)n1 | 10.1021/jm960274q | ||
| CHEMBL65833 | 201756 | 0 | None | -53 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 438 | 9 | 1 | 7 | 3.5 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2cccc(C)c2)c2cccc(C)c2)n1 | 10.1021/jm960274q | ||
| 11103181 | 98925 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 507 | 7 | 1 | 7 | 4.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCN(C)C2=O)c1C | 10.1021/jm020289q | ||
| CHEMBL282628 | 98925 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 507 | 7 | 1 | 7 | 4.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCN(C)C2=O)c1C | 10.1021/jm020289q | ||
| 9915028 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | nan | ||
| CHEMBL111612 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | nan | ||
| CHEMBL4761843 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | nan | ||
| 9915028 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL111612 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| CHEMBL4761843 | 9321 | 12 | None | -28183 | 2 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 532 | 15 | 1 | 6 | 5.5 | CCCCN(CCCC)C(=O)CN1C[C@H](c2cc(OC)c3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1CC(C)(C)CCC | 10.1021/jm980217s | ||
| 9914310 | 204917 | 3 | None | -1995 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8923 | 204917 | 3 | None | -1995 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 510 | 12 | 1 | 6 | 4.7 | CCCCN(CCCC)C(=O)CN1CC(c2ccc3c(c2)OCO3)C(C(=O)O)C1c1ccc(OC)cc1 | 10.1021/jm9505369 | ||
| 9870830 | 204987 | 34 | None | -66 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9505369 | ||
| CHEMBL8981 | 204987 | 34 | None | -66 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 506 | 8 | 1 | 9 | 3.8 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OC)c2)cc1 | 10.1021/jm9505369 | ||
| 23670447 | 2980 | 2 | None | -114 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm980217s | ||
| 999 | 2980 | 2 | None | -114 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm980217s | ||
| CHEMBL1204799 | 2980 | 2 | None | -114 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm980217s | ||
| CHEMBL25438 | 2980 | 2 | None | -114 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 528 | 10 | 0 | 9 | 0.1 | COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+] | 10.1021/jm980217s | ||
| 9849547 | 183424 | 0 | None | -34 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H](c1ccc(OC)cc1OCC(=O)O)[C@@H](C(=O)O)[C@@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00273-6 | ||
| CHEMBL48196 | 183424 | 0 | None | -34 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H](c1ccc(OC)cc1OCC(=O)O)[C@@H](C(=O)O)[C@@H]2c1ccc2c(c1)OCO2 | 10.1016/s0960-894x(01)00273-6 | ||
| 10768897 | 107171 | 0 | None | -6 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 544 | 13 | 1 | 8 | 4.8 | COc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(OC)c(OC)c2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL319031 | 107171 | 0 | None | -6 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 544 | 13 | 1 | 8 | 4.8 | COc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(OC)c(OC)c2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| 108002 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm00037a003 | ||
| 3528 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm00037a003 | ||
| CHEMBL8823 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm00037a003 | ||
| 108002 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm9505369 | ||
| 3528 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm9505369 | ||
| CHEMBL8823 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm9505369 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm000538f | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm000538f | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm000538f | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm000538f | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm000538f | ||
| 10741151 | 42821 | 0 | None | -223 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 427 | 8 | 2 | 5 | 5.4 | CCNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL150474 | 42821 | 0 | None | -223 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 427 | 8 | 2 | 5 | 5.4 | CCNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 10743346 | 102138 | 0 | None | -4 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 480 | 11 | 1 | 7 | 4.7 | COc1cc(OC)nc(OC(C(=O)O)C(OCCC(C)(C)C)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL304173 | 102138 | 0 | None | -4 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 480 | 11 | 1 | 7 | 4.7 | COc1cc(OC)nc(OC(C(=O)O)C(OCCC(C)(C)C)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10941181 | 98886 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 624 | 9 | 1 | 7 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccc(C(F)(F)F)cc2)c1C | 10.1021/jm020289q | ||
| CHEMBL282336 | 98886 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 624 | 9 | 1 | 7 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccc(C(F)(F)F)cc2)c1C | 10.1021/jm020289q | ||
| 11730445 | 101438 | 0 | None | -4677 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 475 | 7 | 1 | 8 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2cccn2)c1C | 10.1021/jm020289q | ||
| CHEMBL30092 | 101438 | 0 | None | -4677 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 475 | 7 | 1 | 8 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2cccn2)c1C | 10.1021/jm020289q | ||
| 9807200 | 84921 | 0 | None | -346 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261359 | 84921 | 0 | None | -346 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 536 | 7 | 2 | 8 | 3.6 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(C(=O)O)ccc12 | 10.1007/s00044-004-0021-y | ||
| 10918301 | 101026 | 0 | None | -7585 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 514 | 8 | 1 | 7 | 6.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)c2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL29793 | 101026 | 0 | None | -7585 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 514 | 8 | 1 | 7 | 6.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)c2ccccc2)c1C | 10.1021/jm020289q | ||
| 10620185 | 119146 | 0 | None | -89 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL346853 | 119146 | 0 | None | -89 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10814297 | 201835 | 0 | None | -17 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 472 | 10 | 1 | 7 | 4.3 | COc1cc(OC)nc(OC(C(=O)O)C(Oc2ccccc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL66402 | 201835 | 0 | None | -17 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 472 | 10 | 1 | 7 | 4.3 | COc1cc(OC)nc(OC(C(=O)O)C(Oc2ccccc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 11124425 | 99402 | 0 | None | -75857 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 543 | 7 | 1 | 8 | 5.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2ccc(C(F)(F)F)n2)c1C | 10.1021/jm020289q | ||
| CHEMBL285832 | 99402 | 0 | None | -75857 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 543 | 7 | 1 | 8 | 5.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2ccc(C(F)(F)F)n2)c1C | 10.1021/jm020289q | ||
| 10595347 | 42236 | 0 | None | -537 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 370 | 6 | 1 | 4 | 4.7 | CCCc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| CHEMBL149953 | 42236 | 0 | None | -537 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 370 | 6 | 1 | 4 | 4.7 | CCCc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| 10691439 | 44292 | 0 | None | -245 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 384 | 4 | 1 | 4 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(C(C)(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL151971 | 44292 | 0 | None | -245 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 384 | 4 | 1 | 4 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(C(C)(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 76312118 | 84923 | 0 | None | -691 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| CHEMBL2261361 | 84923 | 0 | None | -691 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 522 | 7 | 2 | 8 | 3.4 | COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@@H](c1ccc2c(c1)OCO2)c1cn(C)c2cc(CO)ccc12 | 10.1007/s00044-004-0021-y | ||
| 9863132 | 162759 | 0 | None | - | 1 | Pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 348 | 6 | 3 | 2 | 3.1 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C1CC1c1ccccc1 | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL418898 | 162759 | 0 | None | - | 1 | Pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 348 | 6 | 3 | 2 | 3.1 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C1CC1c1ccccc1 | 10.1016/0960-894X(96)00421-0 | ||
| 10528863 | 4552 | 0 | None | -4 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(O)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL102868 | 4552 | 0 | None | -4 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 484 | 10 | 2 | 6 | 4.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(O)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| 10786696 | 102314 | 0 | None | -223 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 392 | 8 | 1 | 5 | 3.8 | CCc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL305270 | 102314 | 0 | None | -223 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 392 | 8 | 1 | 5 | 3.8 | CCc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10603135 | 109256 | 0 | None | -1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 570 | 14 | 1 | 7 | 6.0 | CCc1ccc(C(OCCc2ccc(OC)cc2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL322996 | 109256 | 0 | None | -1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 570 | 14 | 1 | 7 | 6.0 | CCc1ccc(C(OCCc2ccc(OC)cc2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10503421 | 119004 | 0 | None | -245 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 443 | 9 | 3 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NCCO)c1C | 10.1021/jm970872k | ||
| CHEMBL345542 | 119004 | 0 | None | -245 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 443 | 9 | 3 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NCCO)c1C | 10.1021/jm970872k | ||
| 9822616 | 121478 | 0 | None | -17782 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 406 | 5 | 1 | 6 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL359273 | 121478 | 0 | None | -17782 | 2 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 406 | 5 | 1 | 6 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 46228086 | 198152 | 0 | None | - | 1 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 10 | 1 | 9 | 4.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCBr)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL594265 | 198152 | 0 | None | - | 1 | Mouse | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 598 | 10 | 1 | 9 | 4.6 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCBr)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| 10505434 | 4598 | 0 | None | -7 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 496 | 11 | 1 | 5 | 5.8 | Cc1ccc(CCCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL103190 | 4598 | 0 | None | -7 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 496 | 11 | 1 | 5 | 5.8 | Cc1ccc(CCCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10691437 | 5013 | 0 | None | -95 | 4 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL105490 | 5013 | 0 | None | -95 | 4 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 9908909 | 5237 | 7 | None | -363 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 399 | 6 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2N)c1C | 10.1021/jm970872k | ||
| CHEMBL106684 | 5237 | 7 | None | -363 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 399 | 6 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2N)c1C | 10.1021/jm970872k | ||
| 11797288 | 201922 | 0 | None | -89 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 11 | 1 | 7 | 3.7 | CCCOC(c1ccccc1)(c1ccccc1)C(Oc1nc(OC)cc(OC)n1)C(=O)O | 10.1021/jm960274q | ||
| CHEMBL67084 | 201922 | 0 | None | -89 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 11 | 1 | 7 | 3.7 | CCCOC(c1ccccc1)(c1ccccc1)C(Oc1nc(OC)cc(OC)n1)C(=O)O | 10.1021/jm960274q | ||
| 10691437 | 5013 | 0 | None | -95 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL105490 | 5013 | 0 | None | -95 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm000105c | ||
| 11081276 | 100753 | 0 | None | -2238 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cc2ncco2)c1C | 10.1021/jm020289q | ||
| CHEMBL29598 | 100753 | 0 | None | -2238 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 476 | 7 | 1 | 8 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cc2ncco2)c1C | 10.1021/jm020289q | ||
| 10864118 | 100998 | 0 | None | -4265 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.2 | CC(=O)N(Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C)C(C)C | 10.1021/jm020289q | ||
| CHEMBL29775 | 100998 | 0 | None | -4265 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.2 | CC(=O)N(Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C)C(C)C | 10.1021/jm020289q | ||
| 10667808 | 118786 | 0 | None | -338 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 385 | 6 | 2 | 5 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(NC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL343867 | 118786 | 0 | None | -338 | 2 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 385 | 6 | 2 | 5 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(NC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 12286 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1021/jm980217s | ||
| 6433095 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1021/jm980217s | ||
| CHEMBL109648 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1021/jm980217s | ||
| DB06677 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 10.1021/jm980217s | ||
| 108002 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm970101g | ||
| 3528 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm970101g | ||
| CHEMBL8823 | 3438 | 14 | None | -56 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 10 | 2 | 7 | 4.7 | CCCOc1ccc2c(c1)[C@H]([C@@H]([C@H]2c1ccc2c(c1)OCO2)C(=O)O)c1ccc(cc1OCC(=O)O)OC | 10.1021/jm970101g | ||
| 44314884 | 160205 | 0 | None | - | 1 | Pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| 77282209 | 160205 | 0 | None | - | 1 | Pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL411399 | 160205 | 0 | None | - | 1 | Pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| 10742005 | 202002 | 0 | None | -162 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2cccc(F)c2)c2cccc(F)c2)n1 | 10.1021/jm960274q | ||
| CHEMBL67536 | 202002 | 0 | None | -162 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2cccc(F)c2)c2cccc(F)c2)n1 | 10.1021/jm960274q | ||
| 13016 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/s0960-894x(01)00791-0 | ||
| 9843631 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL24461 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/s0960-894x(01)00791-0 | ||
| 13016 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm000105c | ||
| 9843631 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm000105c | ||
| CHEMBL24461 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm000105c | ||
| 13016 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm020289q | ||
| 9843631 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm020289q | ||
| CHEMBL24461 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1021/jm020289q | ||
| 9865409 | 101859 | 0 | None | -199 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 3.2 | COc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL303631 | 101859 | 0 | None | -199 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 3.2 | COc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10691438 | 44241 | 0 | None | -51 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 384 | 7 | 1 | 4 | 5.1 | CCCCc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| CHEMBL151926 | 44241 | 0 | None | -51 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 384 | 7 | 1 | 4 | 5.1 | CCCCc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| 10718666 | 121007 | 0 | None | -3 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 457 | 9 | 3 | 6 | 4.5 | Cc1noc(NS(=O)(=O)c2ccc(NCC(=O)O)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL358461 | 121007 | 0 | None | -3 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 457 | 9 | 3 | 6 | 4.5 | Cc1noc(NS(=O)(=O)c2ccc(NCC(=O)O)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 5122650 | 102458 | 6 | None | -100 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 364 | 7 | 1 | 5 | 3.2 | COC(c1ccccc1)(c1ccccc1)C(Oc1nccc(C)n1)C(=O)O | 10.1021/jm960274q | ||
| CHEMBL306218 | 102458 | 6 | None | -100 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 364 | 7 | 1 | 5 | 3.2 | COC(c1ccccc1)(c1ccccc1)C(Oc1nccc(C)n1)C(=O)O | 10.1021/jm960274q | ||
| 13016 | 663 | 9 | None | -1348 | 4 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/j.bmcl.2016.06.014 | ||
| 9843631 | 663 | 9 | None | -1348 | 4 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL24461 | 663 | 9 | None | -1348 | 4 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10.1016/j.bmcl.2016.06.014 | ||
| 11113812 | 100329 | 0 | None | -1258 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2/C=C\c2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL29313 | 100329 | 0 | None | -1258 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2/C=C\c2ccccc2)c1C | 10.1021/jm020289q | ||
| 11103326 | 167342 | 0 | None | -12589 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 520 | 8 | 1 | 7 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)CC(F)(F)F)c1C | 10.1021/jm020289q | ||
| CHEMBL431296 | 167342 | 0 | None | -12589 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 520 | 8 | 1 | 7 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)CC(F)(F)F)c1C | 10.1021/jm020289q | ||
| 10620897 | 41375 | 0 | None | -14 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.3 | Cc1cccc(-c2ccc(CC(C)C)cc2)c1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL149171 | 41375 | 0 | None | -14 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.3 | Cc1cccc(-c2ccc(CC(C)C)cc2)c1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 10761688 | 119350 | 0 | None | -380 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 370 | 5 | 1 | 4 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(C(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL348700 | 119350 | 0 | None | -380 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 370 | 5 | 1 | 4 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(C(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10810897 | 120979 | 0 | None | -3801 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.3 | Cc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL358254 | 120979 | 0 | None | -3801 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 398 | 6 | 1 | 4 | 5.3 | Cc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 197712 | 101710 | 51 | None | -194 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC(c1ccccc1)(c1ccccc1)C(Oc1nc(C)cc(C)n1)C(=O)O | 10.1021/jm960274q | ||
| CHEMBL302753 | 101710 | 51 | None | -194 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 378 | 7 | 1 | 5 | 3.5 | COC(c1ccccc1)(c1ccccc1)C(Oc1nc(C)cc(C)n1)C(=O)O | 10.1021/jm960274q | ||
| 10721484 | 106877 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 554 | 13 | 1 | 6 | 6.3 | CCc1ccc(C(OCCc2ccc(OC)cc2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL317716 | 106877 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 554 | 13 | 1 | 6 | 6.3 | CCc1ccc(C(OCCc2ccc(OC)cc2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10793160 | 97954 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 570 | 13 | 1 | 8 | 5.6 | COc1cc(/C=C/COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc(OC)c1OC | 10.1021/jm9910425 | ||
| CHEMBL275471 | 97954 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 570 | 13 | 1 | 8 | 5.6 | COc1cc(/C=C/COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc(OC)c1OC | 10.1021/jm9910425 | ||
| 10432263 | 101682 | 0 | None | -85 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 420 | 8 | 1 | 6 | 3.4 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCC2 | 10.1021/jm960274q | ||
| CHEMBL302564 | 101682 | 0 | None | -85 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 420 | 8 | 1 | 6 | 3.4 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCC2 | 10.1021/jm960274q | ||
| 10549727 | 164335 | 0 | None | -125 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1cccc(S(=O)(=O)Nc2onc(C)c2C)c1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| CHEMBL422128 | 164335 | 0 | None | -125 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1cccc(S(=O)(=O)Nc2onc(C)c2C)c1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| 10762600 | 167739 | 0 | None | -154 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL434082 | 167739 | 0 | None | -154 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10620958 | 41467 | 0 | None | -331 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 399 | 6 | 1 | 5 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(N(C)C(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL149241 | 41467 | 0 | None | -331 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 399 | 6 | 1 | 5 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(N(C)C(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 44365561 | 42025 | 0 | None | -524 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 404 | 5 | 1 | 4 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccccc3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL149763 | 42025 | 0 | None | -524 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 404 | 5 | 1 | 4 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccccc3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 19085510 | 119050 | 0 | None | -6025 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cccnc3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL345951 | 119050 | 0 | None | -6025 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cccnc3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 11794992 | 4903 | 0 | None | -39810 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cocn3)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL104848 | 4903 | 0 | None | -39810 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cocn3)cc2)c1C | 10.1021/jm000105c | ||
| 10668636 | 121458 | 0 | None | -147 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 399 | 6 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL359167 | 121458 | 0 | None | -147 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 399 | 6 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10508342 | 4662 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 638 | 13 | 1 | 8 | 6.3 | COc1ccc(CCOC(c2ccc(Cl)cc2)(c2ccc(Cl)cc2)C(Oc2nc3c(c(OC)n2)CCC3)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL103605 | 4662 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 638 | 13 | 1 | 8 | 6.3 | COc1ccc(CCOC(c2ccc(Cl)cc2)(c2ccc(Cl)cc2)C(Oc2nc3c(c(OC)n2)CCC3)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 10740469 | 39068 | 0 | None | -154 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 413 | 7 | 2 | 5 | 5.0 | CNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL147081 | 39068 | 0 | None | -154 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 413 | 7 | 2 | 5 | 5.0 | CNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 18660520 | 39326 | 0 | None | -3548 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 406 | 5 | 1 | 6 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cnccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL147340 | 39326 | 0 | None | -3548 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 406 | 5 | 1 | 6 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cnccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 11799974 | 4463 | 0 | None | -12 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 514 | 12 | 1 | 7 | 4.8 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL102307 | 4463 | 0 | None | -12 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 514 | 12 | 1 | 7 | 4.8 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 3921421 | 106815 | 8 | None | -9 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 468 | 10 | 1 | 5 | 5.1 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccccc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL317233 | 106815 | 8 | None | -9 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 468 | 10 | 1 | 5 | 5.1 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccccc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| 10670965 | 42081 | 0 | None | -851 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 9 | 2 | 6 | 4.3 | Cc1noc(NS(=O)(=O)c2cccc(OCCO)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL149819 | 42081 | 0 | None | -851 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 9 | 2 | 6 | 4.3 | Cc1noc(NS(=O)(=O)c2cccc(OCCO)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 11006149 | 100629 | 0 | None | -380 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 550 | 8 | 1 | 7 | 6.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C(=O)C(C)(C)C)C(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL29502 | 100629 | 0 | None | -380 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 550 | 8 | 1 | 7 | 6.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C(=O)C(C)(C)C)C(C)C)c1C | 10.1021/jm020289q | ||
| 10521258 | 120783 | 0 | None | -416 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 342 | 4 | 1 | 4 | 4.1 | Cc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| CHEMBL358020 | 120783 | 0 | None | -416 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 342 | 4 | 1 | 4 | 4.1 | Cc1ccc(-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1 | 10.1021/jm970872k | ||
| 44311810 | 104311 | 0 | None | 35 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| CHEMBL310919 | 104311 | 0 | None | 35 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 596 | 13 | 2 | 7 | 4.0 | CCCCS(=O)(=O)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C | 10.1016/s0960-894x(98)00388-6 | ||
| 10555112 | 4669 | 0 | None | -12 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 572 | 14 | 2 | 8 | 4.6 | COc1cc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)ccc1OCC(=O)O | 10.1021/jm9910425 | ||
| CHEMBL103695 | 4669 | 0 | None | -12 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 572 | 14 | 2 | 8 | 4.6 | COc1cc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)ccc1OCC(=O)O | 10.1021/jm9910425 | ||
| 10648996 | 4288 | 0 | None | -3 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 498 | 11 | 1 | 6 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL101069 | 4288 | 0 | None | -3 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 498 | 11 | 1 | 6 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 9979632 | 102428 | 0 | None | -41 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 422 | 8 | 1 | 7 | 2.8 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCO2 | 10.1021/jm960274q | ||
| CHEMBL305980 | 102428 | 0 | None | -41 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 422 | 8 | 1 | 7 | 2.8 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCO2 | 10.1021/jm960274q | ||
| 45257114 | 198181 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCF)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL594482 | 198181 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCF)c2)cc1 | 10.1021/jm101110w | ||
| 45257114 | 198181 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCF)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL594482 | 198181 | 0 | None | - | 1 | Mouse | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCF)c2)cc1 | 10.1016/j.bmc.2009.08.058 | ||
| 10501166 | 41634 | 0 | None | -47 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2cc(O)ccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL149391 | 41634 | 0 | None | -47 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2cc(O)ccc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10407051 | 99927 | 0 | None | -5 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 374 | 5 | 1 | 3 | 4.7 | COc1ccc([C@H]2c3ccccc3[C@@H](c3ccc(OC)cc3)[C@@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| CHEMBL290026 | 99927 | 0 | None | -5 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 374 | 5 | 1 | 3 | 4.7 | COc1ccc([C@H]2c3ccccc3[C@@H](c3ccc(OC)cc3)[C@@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| 9937336 | 174107 | 1 | None | -229 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 510 | 9 | 1 | 7 | 4.8 | CCCc1nc(C)ccc1O[C@@H](C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL4559129 | 174107 | 1 | None | -229 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 510 | 9 | 1 | 7 | 4.8 | CCCc1nc(C)ccc1O[C@@H](C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2016.06.014 | ||
| 11800649 | 4541 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 542 | 13 | 1 | 7 | 5.5 | CCOc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL102797 | 4541 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 542 | 13 | 1 | 7 | 5.5 | CCOc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 10693607 | 102233 | 0 | None | -354 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 424 | 10 | 1 | 7 | 3.3 | CCOC(c1ccccc1)(c1ccccc1)C(Oc1nc(OC)cc(OC)n1)C(=O)O | 10.1021/jm960274q | ||
| CHEMBL304778 | 102233 | 0 | None | -354 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 424 | 10 | 1 | 7 | 3.3 | CCOC(c1ccccc1)(c1ccccc1)C(Oc1nc(OC)cc(OC)n1)C(=O)O | 10.1021/jm960274q | ||
| 10836754 | 201896 | 0 | None | -14 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 438 | 11 | 1 | 7 | 3.7 | CCOc1cc(OCC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL66893 | 201896 | 0 | None | -14 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 438 | 11 | 1 | 7 | 3.7 | CCOc1cc(OCC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 11124545 | 100903 | 0 | None | -4168 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 557 | 9 | 1 | 8 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccccn2)c1C | 10.1021/jm020289q | ||
| CHEMBL29710 | 100903 | 0 | None | -4168 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 557 | 9 | 1 | 8 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccccn2)c1C | 10.1021/jm020289q | ||
| 44314445 | 160713 | 0 | None | - | 1 | Pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 1486 | 45 | 19 | 18 | -0.8 | 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]cn1)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL412002 | 160713 | 0 | None | - | 1 | Pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 1486 | 45 | 19 | 18 | -0.8 | 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]cn1)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 10670204 | 41293 | 0 | None | -17 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 428 | 7 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2C(=O)O)c1C | 10.1021/jm970872k | ||
| CHEMBL149111 | 41293 | 0 | None | -17 | 2 | Rat | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 428 | 7 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2C(=O)O)c1C | 10.1021/jm970872k | ||
| 11145758 | 101274 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| CHEMBL29972 | 101274 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| 10973218 | 100500 | 0 | None | -3388 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 506 | 8 | 2 | 7 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CNCC(F)(F)F)c1C | 10.1021/jm020289q | ||
| CHEMBL29420 | 100500 | 0 | None | -3388 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 506 | 8 | 2 | 7 | 5.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CNCC(F)(F)F)c1C | 10.1021/jm020289q | ||
| 10525034 | 119169 | 0 | None | -89 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 7 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OCC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL347125 | 119169 | 0 | None | -89 | 2 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 7 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OCC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 11734435 | 100832 | 0 | None | -6456 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 562 | 9 | 1 | 7 | 6.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC2CCCCC2)c1C | 10.1021/jm020289q | ||
| CHEMBL29652 | 100832 | 0 | None | -6456 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 562 | 9 | 1 | 7 | 6.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC2CCCCC2)c1C | 10.1021/jm020289q | ||
| 51003354 | 57761 | 0 | None | - | 1 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 920 | 24 | 1 | 17 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CN(C)S(=O)(=O)c4ccc(F)cc4)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672884 | 57761 | 0 | None | - | 1 | Mouse | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 920 | 24 | 1 | 17 | 4.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CN(C)S(=O)(=O)c4ccc(F)cc4)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 9865409 | 101859 | 0 | None | -199 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 3.2 | COc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL303631 | 101859 | 0 | None | -199 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 3.2 | COc1cc(C)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 10741834 | 43793 | 0 | None | -85 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 441 | 8 | 2 | 5 | 5.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NC(C)C)c1C | 10.1021/jm970872k | ||
| CHEMBL151422 | 43793 | 0 | None | -85 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 441 | 8 | 2 | 5 | 5.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NC(C)C)c1C | 10.1021/jm970872k | ||
| 44311873 | 202765 | 0 | None | 2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 636 | 13 | 2 | 7 | 5.0 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C1CCCCC1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL72358 | 202765 | 0 | None | 2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 636 | 13 | 2 | 7 | 5.0 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C1CCCCC1 | 10.1016/s0960-894x(98)00387-4 | ||
| 44311858 | 96155 | 0 | None | 2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 598 | 13 | 3 | 8 | 2.8 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)O | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL263301 | 96155 | 0 | None | 2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 598 | 13 | 3 | 8 | 2.8 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)O | 10.1016/s0960-894x(98)00387-4 | ||
| 10840560 | 4599 | 0 | None | -2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 558 | 13 | 1 | 8 | 5.2 | COc1cc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc(OC)c1OC | 10.1021/jm9910425 | ||
| CHEMBL103201 | 4599 | 0 | None | -2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 558 | 13 | 1 | 8 | 5.2 | COc1cc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc(OC)c1OC | 10.1021/jm9910425 | ||
| 44311989 | 202865 | 0 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 610 | 14 | 2 | 7 | 4.4 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)CC | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL73042 | 202865 | 0 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 610 | 14 | 2 | 7 | 4.4 | CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)CC | 10.1016/s0960-894x(98)00387-4 | ||
| 44274960 | 99102 | 0 | None | -12 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 450 | 10 | 1 | 6 | 4.9 | COc1cc(OC)nc(CC(C(=O)O)C(C)(Oc2ccc(C(C)C)cc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| CHEMBL283637 | 99102 | 0 | None | -12 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 450 | 10 | 1 | 6 | 4.9 | COc1cc(OC)nc(CC(C(=O)O)C(C)(Oc2ccc(C(C)C)cc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| 44307412 | 201963 | 0 | None | -12 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 10 | 0 | 8 | 4.5 | COC(=O)C(Oc1nc(OC)cc(OC)n1)C(C)(Oc1ccc(C(C)C)cc1)c1ccccc1 | 10.1021/jm960274q | ||
| CHEMBL67325 | 201963 | 0 | None | -12 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 10 | 0 | 8 | 4.5 | COC(=O)C(Oc1nc(OC)cc(OC)n1)C(C)(Oc1ccc(C(C)C)cc1)c1ccccc1 | 10.1021/jm960274q | ||
| 10621777 | 42828 | 0 | None | -12 | 2 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 415 | 7 | 1 | 6 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1[N+](=O)[O-] | 10.1021/jm970872k | ||
| CHEMBL150481 | 42828 | 0 | None | -12 | 2 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 415 | 7 | 1 | 6 | 4.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)c1[N+](=O)[O-] | 10.1021/jm970872k | ||
| 10548904 | 119005 | 0 | None | -380 | 2 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CCC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL345551 | 119005 | 0 | None | -380 | 2 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CCC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 44213540 | 39244 | 0 | None | -831 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 421 | 5 | 1 | 5 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cccc[n+]3[O-])cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL147238 | 39244 | 0 | None | -831 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 421 | 5 | 1 | 5 | 4.1 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cccc[n+]3[O-])cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 11124821 | 98832 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 595 | 8 | 1 | 8 | 6.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2cc3ccccc3n2C)c1C | 10.1021/jm020289q | ||
| CHEMBL281977 | 98832 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 595 | 8 | 1 | 8 | 6.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2cc3ccccc3n2C)c1C | 10.1021/jm020289q | ||
| 10505357 | 108915 | 0 | None | -10 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 494 | 10 | 1 | 5 | 5.9 | Cc1ccc(/C=C/COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL321984 | 108915 | 0 | None | -10 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 494 | 10 | 1 | 5 | 5.9 | Cc1ccc(/C=C/COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10941084 | 101514 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 610 | 8 | 1 | 7 | 7.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2cc(Cl)cc(Cl)c2)c1C | 10.1021/jm020289q | ||
| CHEMBL30150 | 101514 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 610 | 8 | 1 | 7 | 7.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2cc(Cl)cc(Cl)c2)c1C | 10.1021/jm020289q | ||
| 443289 | 703 | 40 | None | -831 | 3 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970872k | ||||
| 997 | 703 | 40 | None | -831 | 3 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970872k | ||||
| CHEMBL314691 | 703 | 40 | None | -831 | 3 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970872k | ||||
| DB12054 | 703 | 40 | None | -831 | 3 | Rat | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970872k | ||||
| 10119517 | 98777 | 0 | None | -169824 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 536 | 8 | 1 | 7 | 5.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC(C)(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL281659 | 98777 | 0 | None | -169824 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 536 | 8 | 1 | 7 | 5.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC(C)(C)C)c1C | 10.1021/jm020289q | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm970101g | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm970101g | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm970101g | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm970101g | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm970101g | ||
| 10669224 | 107980 | 0 | None | -1778 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 409 | 6 | 1 | 6 | 4.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(Cc3ncco3)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL319924 | 107980 | 0 | None | -1778 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 409 | 6 | 1 | 6 | 4.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(Cc3ncco3)cc2)c1C | 10.1021/jm000105c | ||
| 44265871 | 166365 | 0 | None | -53 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 547 | 10 | 2 | 8 | 4.6 | COc1ccccc1Cc1c(CCCO)nc(-c2ncccn2)nc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 | 10.1021/jm9505369 | ||
| CHEMBL428661 | 166365 | 0 | None | -53 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 547 | 10 | 2 | 8 | 4.6 | COc1ccccc1Cc1c(CCCO)nc(-c2ncccn2)nc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 | 10.1021/jm9505369 | ||
| 10692125 | 201374 | 0 | None | -26 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 396 | 8 | 2 | 7 | 2.3 | COc1cc(OC)nc(OC(C(=O)O)C(O)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL63648 | 201374 | 0 | None | -26 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 396 | 8 | 2 | 7 | 2.3 | COc1cc(OC)nc(OC(C(=O)O)C(O)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 9848710 | 168514 | 4 | None | -1 | 4 | Pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 4.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL439759 | 168514 | 4 | None | -1 | 4 | Pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 4.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/0960-894X(96)00421-0 | ||
| 9848710 | 168514 | 4 | None | 1 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 4.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL439759 | 168514 | 4 | None | 1 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 497 | 9 | 3 | 3 | 4.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 11082049 | 99099 | 0 | None | -933 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 534 | 7 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| CHEMBL283610 | 99099 | 0 | None | -933 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 534 | 7 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| 51003353 | 57760 | 0 | None | - | 1 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 886 | 26 | 1 | 17 | 5.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CCCCOc4cccnc4F)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672883 | 57760 | 0 | None | - | 1 | Mouse | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 886 | 26 | 1 | 17 | 5.5 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CCCCOc4cccnc4F)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 10599293 | 38789 | 0 | None | -128 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 441 | 9 | 2 | 5 | 5.8 | CCCNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL146845 | 38789 | 0 | None | -128 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 441 | 9 | 2 | 5 | 5.8 | CCCNc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 9953358 | 94359 | 9 | None | -102 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| CHEMBL25344 | 94359 | 9 | None | -102 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm960274q | ||
| 177236 | 1298 | 39 | None | -134 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 3508 | 1298 | 39 | None | -134 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| CHEMBL23261 | 1298 | 39 | None | -134 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| DB04883 | 1298 | 39 | None | -134 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 9 | 1 | 7 | 2.9 | COC([C@@H](C(=O)O)Oc1nc(OC)cc(n1)OC)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2016.06.014 | ||
| 11082168 | 98758 | 0 | None | -7585 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 548 | 8 | 1 | 7 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC(F)(F)F)c1C | 10.1021/jm020289q | ||
| CHEMBL281549 | 98758 | 0 | None | -7585 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 548 | 8 | 1 | 7 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CC(F)(F)F)c1C | 10.1021/jm020289q | ||
| 10839202 | 118731 | 0 | None | -6 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 503 | 8 | 2 | 5 | 6.2 | Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL343477 | 118731 | 0 | None | -6 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 503 | 8 | 2 | 5 | 6.2 | Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 22103537 | 41827 | 0 | None | -144 | 2 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccno3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL149592 | 41827 | 0 | None | -144 | 2 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccno3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 44311698 | 202410 | 0 | None | 524 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 574 | 10 | 3 | 4 | 5.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccccn3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| CHEMBL70310 | 202410 | 0 | None | 524 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 574 | 10 | 3 | 4 | 5.3 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccc(-c3ccccn3)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1 | 10.1016/s0960-894x(98)00387-4 | ||
| 9893800 | 106746 | 10 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)[C@H](Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/acs.jmedchem.5b01781 | ||
| CHEMBL316735 | 106746 | 10 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)[C@H](Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/acs.jmedchem.5b01781 | ||
| 9893800 | 106746 | 10 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)[C@H](Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL316735 | 106746 | 10 | None | -2 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)[C@H](Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 10769887 | 107006 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 600 | 15 | 1 | 8 | 6.0 | CCc1ccc(C(OCCc2ccc(OC)c(OC)c2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL318535 | 107006 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 600 | 15 | 1 | 8 | 6.0 | CCc1ccc(C(OCCc2ccc(OC)c(OC)c2)(c2ccc(CC)cc2)C(Oc2nc(C)cc(OC)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10528341 | 14408 | 0 | None | -95 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 458 | 9 | 2 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2cccc(OCC(=O)O)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL1204523 | 14408 | 0 | None | -95 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 458 | 9 | 2 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2cccc(OCC(=O)O)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL149152 | 14408 | 0 | None | -95 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 458 | 9 | 2 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2cccc(OCC(=O)O)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 10972867 | 99242 | 0 | None | -19952 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 480 | 7 | 1 | 7 | 4.4 | CC(=O)N(C)Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm020289q | ||
| CHEMBL284656 | 99242 | 0 | None | -19952 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 480 | 7 | 1 | 7 | 4.4 | CC(=O)N(C)Cc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm020289q | ||
| 9852318 | 9523 | 5 | None | -2691 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL112624 | 9523 | 5 | None | -2691 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| CHEMBL1627022 | 9523 | 5 | None | -2691 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 613 | 11 | 2 | 9 | 4.5 | Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1 | 10.1021/jm000538f | ||
| 10715881 | 121027 | 0 | None | -37 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL358545 | 121027 | 0 | None | -37 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 398 | 5 | 1 | 4 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 51003306 | 57757 | 0 | None | - | 1 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 670 | 19 | 1 | 12 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCF)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672880 | 57757 | 0 | None | - | 1 | Mouse | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 670 | 19 | 1 | 12 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCF)c2)cc1 | 10.1021/jm101110w | ||
| 10718053 | 43863 | 0 | None | -5 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 442 | 8 | 1 | 6 | 4.8 | CCOC(=O)c1c(C)noc1NS(=O)(=O)c1ccccc1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| CHEMBL151525 | 43863 | 0 | None | -5 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 442 | 8 | 1 | 6 | 4.8 | CCOC(=O)c1c(C)noc1NS(=O)(=O)c1ccccc1-c1ccc(CC(C)C)cc1 | 10.1021/jm970872k | ||
| 11123603 | 101326 | 0 | None | -14125 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 475 | 7 | 1 | 8 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2ccnc2)c1C | 10.1021/jm020289q | ||
| CHEMBL30009 | 101326 | 0 | None | -14125 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 475 | 7 | 1 | 8 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2Cn2ccnc2)c1C | 10.1021/jm020289q | ||
| 11754273 | 100504 | 0 | None | -21877 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm000105c | ||
| CHEMBL29422 | 100504 | 0 | None | -21877 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm000105c | ||
| 11754273 | 100504 | 0 | None | -21877 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm020289q | ||
| CHEMBL29422 | 100504 | 0 | None | -21877 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cc(-c2ncco2)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm020289q | ||
| 11795351 | 42603 | 0 | None | -109 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 401 | 6 | 1 | 4 | 4.8 | CC(C)Cc1ccc(-c2ccccc2S(=O)(=O)Nc2ccc(Cl)nn2)cc1 | 10.1021/jm970872k | ||
| CHEMBL150273 | 42603 | 0 | None | -109 | 2 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 401 | 6 | 1 | 4 | 4.8 | CC(C)Cc1ccc(-c2ccccc2S(=O)(=O)Nc2ccc(Cl)nn2)cc1 | 10.1021/jm970872k | ||
| 11103112 | 99406 | 0 | None | -4570 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 501 | 8 | 1 | 7 | 6.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COc2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL28586 | 99406 | 0 | None | -4570 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 501 | 8 | 1 | 7 | 6.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COc2ccccc2)c1C | 10.1021/jm020289q | ||
| 44274885 | 93652 | 0 | None | -29 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 454 | 10 | 1 | 7 | 4.5 | COc1cc(OC)nc(CC(C(=O)O)C(C)(Oc2ccc(SC)cc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| CHEMBL24906 | 93652 | 0 | None | -29 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 454 | 10 | 1 | 7 | 4.5 | COc1cc(OC)nc(CC(C(=O)O)C(C)(Oc2ccc(SC)cc2)c2ccccc2)n1 | 10.1021/jm030480f | ||
| 44307287 | 202063 | 0 | None | -29 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 470 | 10 | 0 | 9 | 4.1 | COC(=O)C(Oc1nc(OC)cc(OC)n1)C(C)(Oc1ccc(SC)cc1)c1ccccc1 | 10.1021/jm960274q | ||
| CHEMBL67957 | 202063 | 0 | None | -29 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 470 | 10 | 0 | 9 | 4.1 | COC(=O)C(Oc1nc(OC)cc(OC)n1)C(C)(Oc1ccc(SC)cc1)c1ccccc1 | 10.1021/jm960274q | ||
| 11059912 | 98881 | 0 | None | -23988 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 481 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COCC(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL282303 | 98881 | 0 | None | -23988 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 481 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2COCC(C)C)c1C | 10.1021/jm020289q | ||
| 19085508 | 39348 | 0 | None | -218 | 2 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 466 | 7 | 1 | 8 | 4.2 | COc1cc(OC)nc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)n1 | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL147365 | 39348 | 0 | None | -218 | 2 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 466 | 7 | 1 | 8 | 4.2 | COc1cc(OC)nc(-c2ccc(-c3ccccc3S(=O)(=O)Nc3onc(C)c3C)cc2)n1 | 10.1016/s0960-894x(01)00791-0 | ||
| 10453858 | 159555 | 0 | None | -31 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 404 | 4 | 2 | 5 | 4.1 | COc1ccc([C@@H]2c3cc(O)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| CHEMBL41087 | 159555 | 0 | None | -31 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 404 | 4 | 2 | 5 | 4.1 | COc1ccc([C@@H]2c3cc(O)ccc3[C@H](c3ccc4c(c3)OCO4)[C@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| 9955561 | 102380 | 0 | None | - | 1 | Pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 453 | 8 | 2 | 2 | 4.8 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)c1 | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL305615 | 102380 | 0 | None | - | 1 | Pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 453 | 8 | 2 | 2 | 4.8 | Cc1cc(C)cc(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)NCCc2c[nH]c3ccccc23)c1 | 10.1016/0960-894X(96)00421-0 | ||
| 44314882 | 156634 | 0 | None | 380 | 2 | Pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 1562 | 47 | 19 | 18 | 0.4 | 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]cn1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 77282212 | 156634 | 0 | None | 380 | 2 | Pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 1562 | 47 | 19 | 18 | 0.4 | 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]cn1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL407559 | 156634 | 0 | None | 380 | 2 | Pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 1562 | 47 | 19 | 18 | 0.4 | 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]cn1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 9894460 | 204982 | 6 | None | -41 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm9505369 | ||
| CHEMBL313871 | 204982 | 6 | None | -41 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm9505369 | ||
| CHEMBL8978 | 204982 | 6 | None | -41 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 539 | 10 | 2 | 7 | 4.8 | CCCc1cc(C(=O)O)ccc1OC(C(=O)NS(=O)(=O)c1ccc(C(C)C)cc1)c1ccc2c(c1)OCO2 | 10.1021/jm9505369 | ||
| 44314883 | 155220 | 0 | None | - | 1 | Pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 77282211 | 155220 | 0 | None | - | 1 | Pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL405796 | 155220 | 0 | None | - | 1 | Pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC | 10.1016/0960-894X(96)00421-0 | ||
| 10526510 | 120555 | 0 | None | -12 | 2 | Rat | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 427 | 8 | 1 | 6 | 4.2 | COc1cc(OC)nc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)n1 | 10.1021/jm970872k | ||
| CHEMBL356972 | 120555 | 0 | None | -12 | 2 | Rat | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 427 | 8 | 1 | 6 | 4.2 | COc1cc(OC)nc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2)n1 | 10.1021/jm970872k | ||
| 44314819 | 155216 | 0 | None | - | 1 | Pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| 77282207 | 155216 | 0 | None | - | 1 | Pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| CHEMBL405753 | 155216 | 0 | None | - | 1 | Pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1520 | 45 | 19 | 18 | -0.6 | 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]cn1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1016/0960-894X(96)00421-0 | ||
| 22103743 | 42590 | 0 | None | -9332 | 2 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 411 | 5 | 1 | 6 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nccs3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL150260 | 42590 | 0 | None | -9332 | 2 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 411 | 5 | 1 | 6 | 4.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nccs3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 51003352 | 57759 | 0 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1020 | 35 | 1 | 21 | 4.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCOCc3cn(CCOCCOCCOCCOc4cccnc4F)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672882 | 57759 | 0 | None | - | 1 | Mouse | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 1020 | 35 | 1 | 21 | 4.7 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCOCc3cn(CCOCCOCCOCCOc4cccnc4F)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 10647471 | 42080 | 0 | None | -125 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 456 | 7 | 3 | 5 | 4.7 | CNC(=O)Nc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL149818 | 42080 | 0 | None | -125 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 456 | 7 | 3 | 5 | 4.7 | CNC(=O)Nc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 10597897 | 40934 | 0 | None | -724 | 2 | Rat | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| CHEMBL148853 | 40934 | 0 | None | -724 | 2 | Rat | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1cc(CC(C)C)ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C | 10.1021/jm970872k | ||
| 10624645 | 4267 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 482 | 10 | 1 | 5 | 5.4 | Cc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL100954 | 4267 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 482 | 10 | 1 | 5 | 5.4 | Cc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 10929533 | 99891 | 0 | None | -10964 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C(=O)C(C)C)C2CC2)c1C | 10.1021/jm020289q | ||
| CHEMBL28963 | 99891 | 0 | None | -10964 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C(=O)C(C)C)C2CC2)c1C | 10.1021/jm020289q | ||
| 10432263 | 101682 | 0 | None | -85 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 420 | 8 | 1 | 6 | 3.4 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCC2 | 10.1021/jm960274q | ||
| CHEMBL302564 | 101682 | 0 | None | -85 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 420 | 8 | 1 | 6 | 3.4 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCC2 | 10.1021/jm960274q | ||
| 10643748 | 120923 | 0 | None | -29 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2cccc(CC(C)C)c2)c1C | 10.1021/jm970872k | ||
| CHEMBL358226 | 120923 | 0 | None | -29 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 384 | 6 | 1 | 4 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2cccc(CC(C)C)c2)c1C | 10.1021/jm970872k | ||
| 9979632 | 102428 | 0 | None | -41 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 422 | 8 | 1 | 7 | 2.8 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCO2 | 10.1021/jm960274q | ||
| CHEMBL305980 | 102428 | 0 | None | -41 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 422 | 8 | 1 | 7 | 2.8 | COc1nc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc2c1CCO2 | 10.1021/jm960274q | ||
| 10501299 | 119349 | 0 | None | -147 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 402 | 6 | 1 | 5 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(SC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL348685 | 119349 | 0 | None | -147 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 402 | 6 | 1 | 5 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(SC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 11813553 | 98887 | 0 | None | -14454 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 542 | 8 | 1 | 7 | 5.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL282359 | 98887 | 0 | None | -14454 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 542 | 8 | 1 | 7 | 5.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)c2ccccc2)c1C | 10.1021/jm020289q | ||
| 10815239 | 108071 | 0 | None | -125 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 500 | 10 | 1 | 7 | 5.0 | COc1ccc(OC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL320224 | 108071 | 0 | None | -125 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 500 | 10 | 1 | 7 | 5.0 | COc1ccc(OC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 10690608 | 120546 | 0 | None | -112 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 371 | 5 | 1 | 5 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(N(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL356901 | 120546 | 0 | None | -112 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 371 | 5 | 1 | 5 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(N(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 19934534 | 106213 | 0 | None | 5 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 468 | 6 | 3 | 4 | 5.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)c3cc4ccccc4[nH]3)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL314364 | 106213 | 0 | None | 5 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 468 | 6 | 3 | 4 | 5.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)c3cc4ccccc4[nH]3)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 10837085 | 101839 | 0 | None | -39 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2F)c2ccccc2F)n1 | 10.1021/jm960274q | ||
| CHEMBL303501 | 101839 | 0 | None | -39 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccccc2F)c2ccccc2F)n1 | 10.1021/jm960274q | ||
| 19934546 | 204492 | 0 | None | -8 | 2 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(OCc3cccc4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL86581 | 204492 | 0 | None | -8 | 2 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(OCc3cccc4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 10693130 | 121455 | 0 | None | -16 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(-c2ccc(CC(C)C)cc2)c1 | 10.1021/jm970872k | ||
| CHEMBL359152 | 121455 | 0 | None | -16 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 5.0 | COc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(-c2ccc(CC(C)C)cc2)c1 | 10.1021/jm970872k | ||
| 11799973 | 4366 | 0 | None | -31 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 514 | 11 | 1 | 7 | 5.1 | COc1ccc(COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL101587 | 4366 | 0 | None | -31 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 514 | 11 | 1 | 7 | 5.1 | COc1ccc(COC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 18660521 | 41455 | 0 | None | -2754 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL149232 | 41455 | 0 | None | -2754 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ccccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 11731054 | 98355 | 0 | None | -21379 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 522 | 7 | 1 | 7 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)C(C)(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL27855 | 98355 | 0 | None | -21379 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 522 | 7 | 1 | 7 | 5.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)C(C)(C)C)c1C | 10.1021/jm020289q | ||
| 51002602 | 57763 | 0 | None | - | 1 | Mouse | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 751 | 21 | 1 | 15 | 4.0 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CF)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672886 | 57763 | 0 | None | - | 1 | Mouse | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 751 | 21 | 1 | 15 | 4.0 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CF)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 9864017 | 41087 | 0 | None | -194 | 2 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 367 | 4 | 2 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2cc3ccccc3[nH]2)c1C | 10.1021/jm970872k | ||
| CHEMBL148967 | 41087 | 0 | None | -194 | 2 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 367 | 4 | 2 | 4 | 4.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2cc3ccccc3[nH]2)c1C | 10.1021/jm970872k | ||
| 10741144 | 119264 | 0 | None | -407 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 427 | 8 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NC=O)c1C | 10.1021/jm970872k | ||
| CHEMBL347982 | 119264 | 0 | None | -407 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 427 | 8 | 2 | 5 | 4.5 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2NC=O)c1C | 10.1021/jm970872k | ||
| 6433100 | 4481 | 6 | None | -2 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| CHEMBL102405 | 4481 | 6 | None | -2 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 528 | 12 | 1 | 7 | 5.1 | COc1ccc(CCOC(c2ccccc2)(c2ccccc2)C(Oc2nc(C)cc(C)n2)C(=O)O)cc1OC | 10.1021/jm9910425 | ||
| 443289 | 703 | 40 | None | -831 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00019-P | ||||
| 997 | 703 | 40 | None | -831 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00019-P | ||||
| CHEMBL314691 | 703 | 40 | None | -831 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00019-P | ||||
| DB12054 | 703 | 40 | None | -831 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | None | 10.1016/0960-894X(95)00019-P | ||||
| 19934544 | 204479 | 0 | None | 2 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 482 | 7 | 3 | 4 | 4.9 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)Cc3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL86489 | 204479 | 0 | None | 2 | 2 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 482 | 7 | 3 | 4 | 4.9 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NC(=O)Cc3c[nH]c4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 44333366 | 106942 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 570 | 12 | 1 | 8 | 5.2 | COc1ccc(CCOC(c2ccc(C)cc2)(c2ccc(C)cc2)C(Oc2nc3c(c(OC)n2)COC3)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| CHEMBL318146 | 106942 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 570 | 12 | 1 | 8 | 5.2 | COc1ccc(CCOC(c2ccc(C)cc2)(c2ccc(C)cc2)C(Oc2nc3c(c(OC)n2)COC3)C(=O)O)cc1 | 10.1021/jm9910425 | ||
| 46228116 | 199537 | 0 | None | - | 1 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 598 | 10 | 1 | 9 | 4.6 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCBr)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL603635 | 199537 | 0 | None | - | 1 | Mouse | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 598 | 10 | 1 | 9 | 4.6 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCBr)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| 11733544 | 98778 | 0 | None | -7244 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 480 | 7 | 1 | 7 | 4.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CC(=O)N(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL281668 | 98778 | 0 | None | -7244 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 480 | 7 | 1 | 7 | 4.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CC(=O)N(C)C)c1C | 10.1021/jm020289q | ||
| 10503999 | 41073 | 0 | None | -6 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 456 | 8 | 3 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CN)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL148953 | 41073 | 0 | None | -6 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 456 | 8 | 3 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CN)cc2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 22103385 | 120572 | 0 | None | -19054 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 396 | 5 | 1 | 7 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nnco3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL357077 | 120572 | 0 | None | -19054 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 396 | 5 | 1 | 7 | 3.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nnco3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 10045790 | 141120 | 0 | None | -17 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 388 | 4 | 1 | 4 | 4.4 | COc1ccc([C@H]2c3ccccc3[C@@H](c3ccc4c(c3)OCO4)[C@@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| CHEMBL38537 | 141120 | 0 | None | -17 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 388 | 4 | 1 | 4 | 4.4 | COc1ccc([C@H]2c3ccccc3[C@@H](c3ccc4c(c3)OCO4)[C@@H]2C(=O)O)cc1 | 10.1021/jm00037a003 | ||
| 9958321 | 78741 | 0 | None | -19498 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| CHEMBL2113316 | 78741 | 0 | None | -19498 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CCC(C)(C)C2=O)c1C | 10.1021/jm020289q | ||
| 10548722 | 5406 | 0 | None | -20892 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cnco3)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL107574 | 5406 | 0 | None | -20892 | 2 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 395 | 5 | 1 | 6 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cnco3)cc2)c1C | 10.1021/jm000105c | ||
| 11027595 | 99777 | 0 | None | -19952 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)C(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL28863 | 99777 | 0 | None | -19952 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 508 | 8 | 1 | 7 | 5.0 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)C(C)C)c1C | 10.1021/jm020289q | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm020289q | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm020289q | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm020289q | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm020289q | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 10.1021/jm020289q | ||
| 15297287 | 163860 | 0 | None | 3 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 5 | 2 | 4 | 5.2 | O=C(O)CN1C(=O)c2ccccc2Nc2ccc(OCc3cccc4ccccc34)cc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL421349 | 163860 | 0 | None | 3 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 5 | 2 | 4 | 5.2 | O=C(O)CN1C(=O)c2ccccc2Nc2ccc(OCc3cccc4ccccc34)cc21 | 10.1016/0960-894X(95)00019-P | ||
| 44277840 | 97802 | 0 | None | -81283 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 522 | 7 | 1 | 7 | 5.8 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2N(C)C(=O)CC(C)(C)C)c1C | 10.1021/jm020289q | ||
| CHEMBL274489 | 97802 | 0 | None | -81283 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 522 | 7 | 1 | 7 | 5.8 | Cc1onc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2N(C)C(=O)CC(C)(C)C)c1C | 10.1021/jm020289q | ||
| 10836583 | 39455 | 0 | None | -43 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 434 | 7 | 1 | 5 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OCc3ccccc3)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL147521 | 39455 | 0 | None | -43 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 434 | 7 | 1 | 5 | 5.3 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(OCc3ccccc3)cc2)c1C | 10.1021/jm970872k | ||
| 51003307 | 57758 | 0 | None | - | 1 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 751 | 21 | 1 | 15 | 4.0 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCc3cn(CCOCCOCCOCCF)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672881 | 57758 | 0 | None | - | 1 | Mouse | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 751 | 21 | 1 | 15 | 4.0 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCc3cn(CCOCCOCCOCCF)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 11071765 | 168641 | 0 | None | -8709 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 556 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL440780 | 168641 | 0 | None | -8709 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 556 | 9 | 1 | 7 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)Cc2ccccc2)c1C | 10.1021/jm020289q | ||
| 51002601 | 57762 | 0 | None | - | 1 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 906 | 24 | 2 | 17 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CNS(=O)(=O)c4ccc(F)cc4)nn3)c2)cc1 | 10.1021/jm101110w | ||
| CHEMBL1672885 | 57762 | 0 | None | - | 1 | Mouse | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 906 | 24 | 2 | 17 | 4.2 | COc1ccc(C2(O)OC(=O)C(c3ccc4c(c3)OCO4)=C2Cc2cc(OC)c(OC)c(OCCOCCOCCOCCn3cc(CNS(=O)(=O)c4ccc(F)cc4)nn3)c2)cc1 | 10.1021/jm101110w | ||
| 9934204 | 106462 | 0 | None | 1 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 465 | 7 | 2 | 4 | 6.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NCc3cccc4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| CHEMBL314915 | 106462 | 0 | None | 1 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 465 | 7 | 2 | 4 | 6.0 | CCCN1c2ccccc2C(=O)N(CC(=O)O)c2cc(NCc3cccc4ccccc34)ccc21 | 10.1016/0960-894X(95)00019-P | ||
| 11049336 | 99478 | 0 | None | -3630 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2/C=C/c2ccccc2)c1C | 10.1021/jm020289q | ||
| CHEMBL286279 | 99478 | 0 | None | -3630 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2/C=C/c2ccccc2)c1C | 10.1021/jm020289q | ||
| 10673091 | 162774 | 0 | None | -4 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 502 | 10 | 1 | 5 | 5.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(Cl)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| CHEMBL418992 | 162774 | 0 | None | -4 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 502 | 10 | 1 | 5 | 5.8 | Cc1cc(C)nc(OC(C(=O)O)C(OCCc2ccc(Cl)cc2)(c2ccccc2)c2ccccc2)n1 | 10.1021/jm9910425 | ||
| 10621010 | 164310 | 0 | None | -186 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2cccc(O)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| CHEMBL421955 | 164310 | 0 | None | -186 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2cccc(O)c2-c2ccc(CC(C)C)cc2)c1C | 10.1021/jm970872k | ||
| 22103787 | 40751 | 0 | None | -1380 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 394 | 5 | 1 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-n3cccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| CHEMBL148719 | 40751 | 0 | None | -1380 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 394 | 5 | 1 | 6 | 3.9 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-n3cccn3)cc2)c1C | 10.1016/s0960-894x(01)00791-0 | ||
| 10811477 | 4750 | 0 | None | -19952 | 2 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncoc3C)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL104172 | 4750 | 0 | None | -19952 | 2 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 409 | 5 | 1 | 6 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncoc3C)cc2)c1C | 10.1021/jm000105c | ||
| 10813228 | 107174 | 0 | None | -46 | 2 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 445 | 5 | 1 | 6 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nc4ccccc4o3)cc2)c1C | 10.1021/jm000105c | ||
| CHEMBL319036 | 107174 | 0 | None | -46 | 2 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 445 | 5 | 1 | 6 | 5.6 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3nc4ccccc4o3)cc2)c1C | 10.1021/jm000105c | ||
| 10918368 | 102050 | 0 | None | -21379 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CC(C)(C)CC2=O)c1C | 10.1021/jm020289q | ||
| CHEMBL30405 | 102050 | 0 | None | -21379 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 520 | 7 | 1 | 7 | 5.2 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN2CC(C)(C)CC2=O)c1C | 10.1021/jm020289q | ||
| 46228118 | 200855 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 690 | 13 | 1 | 12 | 4.7 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCOc3ccc(S(C)(=O)=O)cc3)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL611626 | 200855 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 690 | 13 | 1 | 12 | 4.7 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCOc3ccc(S(C)(=O)=O)cc3)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| 10573784 | 164785 | 0 | None | -95 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 413 | 7 | 2 | 5 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CN)c1C | 10.1021/jm970872k | ||
| CHEMBL423583 | 164785 | 0 | None | -95 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 413 | 7 | 2 | 5 | 4.4 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2CN)c1C | 10.1021/jm970872k | ||
| 10671031 | 102221 | 0 | None | -29 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(F)cc2)c2ccc(F)cc2)n1 | 10.1021/jm960274q | ||
| CHEMBL304721 | 102221 | 0 | None | -29 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 446 | 9 | 1 | 7 | 3.2 | COc1cc(OC)nc(OC(C(=O)O)C(OC)(c2ccc(F)cc2)c2ccc(F)cc2)n1 | 10.1021/jm960274q | ||
| 45257115 | 199647 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCF)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| CHEMBL604286 | 199647 | 0 | None | - | 1 | Mouse | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 538 | 10 | 1 | 9 | 4.2 | COc1cc(CC2=C(c3ccc4c(c3)OCO4)C(=O)OC2(O)c2ccc(OCCF)cc2)cc(OC)c1OC | 10.1016/j.bmc.2009.08.058 | ||
| 10973161 | 100575 | 0 | None | -6456 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 502 | 8 | 2 | 9 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CNc2ccncn2)c1C | 10.1021/jm020289q | ||
| CHEMBL29464 | 100575 | 0 | None | -6456 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 502 | 8 | 2 | 9 | 4.8 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CNc2ccncn2)c1C | 10.1021/jm020289q | ||
| 10741830 | 42597 | 0 | None | -3 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 441 | 7 | 2 | 5 | 4.9 | CC(=O)Nc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(-c2ccc(CC(C)C)cc2)c1 | 10.1021/jm970872k | ||
| CHEMBL150269 | 42597 | 0 | None | -3 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 441 | 7 | 2 | 5 | 4.9 | CC(=O)Nc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(-c2ccc(CC(C)C)cc2)c1 | 10.1021/jm970872k | ||
| 10668703 | 164631 | 0 | None | -1230 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2O)c1C | 10.1021/jm970872k | ||
| CHEMBL422851 | 164631 | 0 | None | -1230 | 2 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 400 | 6 | 2 | 5 | 4.7 | Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(CC(C)C)cc2O)c1C | 10.1021/jm970872k | ||
| 5344 | 172901 | 98 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 267 | 3 | 2 | 5 | 1.7 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C | None | ||
| CHEMBL453 | 172901 | 98 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 267 | 3 | 2 | 5 | 1.7 | Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C | None | ||
| 6662 | 216019 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 309 | 3 | 1 | 6 | 1.6 | CC(=O)N(C1=C(C)C(C)=NO1)S(=O)(=O)C1=CC=C(N)C=C1 | None | ||
| 11477084 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| 216235 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| 3548 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| 3950 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| CHEMBL282724 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| DB06268 | 3553 | 46 | None | - | 2 | Human | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 454 | 6 | 1 | 8 | 4.0 | O=C(c1sccc1S(=O)(=O)Nc1onc(c1Cl)C)Cc1cc2OCOc2cc1C | None | ||
| 16004692 | 2421 | 85 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | None | ||
| 4809 | 2421 | 85 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | None | ||
| 7352 | 2421 | 85 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | None | ||
| CHEMBL2103873 | 2421 | 85 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | None | ||
| DB08932 | 2421 | 85 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 586 | 11 | 2 | 8 | 3.6 | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)OCCOc1ncc(cn1)Br | None | ||
| 1007 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 16130933 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 16133819 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 3886 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 56947141 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| CHEMBL3188091 | 3584 | 0 | None | -3 | 2 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 3887 | 2041 | 39 | None | -7 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 5311192 | 2041 | 39 | None | -7 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| CHEMBL72410 | 2041 | 39 | None | -7 | 4 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 1010 | 705 | 0 | None | 2 | 2 | Human | 8.0 | pKd | = | 8.0 | Binding | Guide to Pharmacology | 641 | 11 | 3 | 8 | 4.9 | CCCC[C@@H](N(C(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@H](C)CCC[C@@H]1C)C(=O)[C@@H](Cc1cn(c2c1cccc2)C(=O)OC)N)C(=O)O | 8904635 | ||
| 3081333 | 705 | 0 | None | 2 | 2 | Human | 8.0 | pKd | = | 8.0 | Binding | Guide to Pharmacology | 641 | 11 | 3 | 8 | 4.9 | CCCC[C@@H](N(C(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@H](C)CCC[C@@H]1C)C(=O)[C@@H](Cc1cn(c2c1cccc2)C(=O)OC)N)C(=O)O | 8904635 | ||
| 1009 | 192 | 20 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10479298 | ||
| 5310991 | 192 | 20 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10479298 | ||
| CHEMBL332794 | 192 | 20 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | 558 | 11 | 2 | 6 | 5.8 | CCCOc1ccc(cc1)[C@@H]1N(CC(=O)Nc2c(CC)cccc2CC)C[C@@H]([C@H]1C(=O)O)c1ccc2c(c1)OCO2 | 10479298 | ||
| 3837 | 331 | 0 | None | - | 1 | Human | 9.0 | pKd | = | 9.0 | Binding | Guide to Pharmacology | None | None | None | None | 1472961 | ||||
| 1008 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8587419 | ||||
| 1008 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 16132429 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8587419 | ||||
| 16132429 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| CHEMBL1790178 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8587419 | ||||
| CHEMBL1790178 | 3417 | 0 | None | -15 | 2 | Human | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 1007 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 16130933 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 16133819 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 3886 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 56947141 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| CHEMBL3188091 | 3584 | 0 | None | 3 | 2 | Rat | 10.0 | pKd | = | 10.0 | Binding | Guide to Pharmacology | None | None | None | None | 8301559 | ||||
| 1004 | 1535 | 0 | None | -2 | 2 | Rat | 10.3 | pKd | None | 10.3 | Binding | Guide to Pharmacology | None | None | None | None | 1850245 | ||||
| 1004 | 1535 | 0 | None | -2 | 2 | Rat | 10.3 | pKd | None | 10.3 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 16219334 | 1535 | 0 | None | -2 | 2 | Rat | 10.3 | pKd | None | 10.3 | Binding | Guide to Pharmacology | None | None | None | None | 1850245 | ||||
| 16219334 | 1535 | 0 | None | -2 | 2 | Rat | 10.3 | pKd | None | 10.3 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 1008 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850245 | ||||
| 1008 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 16132429 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850245 | ||||
| 16132429 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| CHEMBL1790178 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 1850245 | ||||
| CHEMBL1790178 | 3417 | 0 | None | 15 | 2 | Rat | 10.5 | pKd | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 1004 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 7524189 | ||||
| 1004 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 8460684 | ||||
| 1004 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 16219334 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 7524189 | ||||
| 16219334 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 8460684 | ||||
| 16219334 | 1535 | 0 | None | 2 | 2 | Human | 10.7 | pKd | None | 10.7 | Binding | Guide to Pharmacology | None | None | None | None | 8904635 | ||||
| 1010 | 705 | 0 | None | -2 | 2 | Rat | 7.5 | pKd | None | 7.5 | Binding | Guide to Pharmacology | 641 | 11 | 3 | 8 | 4.9 | CCCC[C@@H](N(C(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@H](C)CCC[C@@H]1C)C(=O)[C@@H](Cc1cn(c2c1cccc2)C(=O)OC)N)C(=O)O | 8904635 | ||
| 3081333 | 705 | 0 | None | -2 | 2 | Rat | 7.5 | pKd | None | 7.5 | Binding | Guide to Pharmacology | 641 | 11 | 3 | 8 | 4.9 | CCCC[C@@H](N(C(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@H](C)CCC[C@@H]1C)C(=O)[C@@H](Cc1cn(c2c1cccc2)C(=O)OC)N)C(=O)O | 8904635 | ||
| 186002 | 102369 | 19 | 125I-ENDOTHELIN | -3 | 3 | Human | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 531 | 10 | 2 | 6 | 5.4 | CCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1C[C@H](C)C(=O)O)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | None | ||
| CHEMBL305576 | 102369 | 19 | 125I-ENDOTHELIN | -3 | 3 | Human | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 531 | 10 | 2 | 6 | 5.4 | CCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1C[C@H](C)C(=O)O)[C@H](C(=O)O)[C@H]2c1ccc2c(c1)OCO2 | None | ||
| 44208932 | 140176 | 6 | UNDEFINED | -120226 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | ||
| CHEMBL381689 | 140176 | 6 | UNDEFINED | -120226 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | ||
| 1973 | 201790 | 12 | 125I-ENDOTHELIN | -3 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | ||
| CHEMBL1394464 | 201790 | 12 | 125I-ENDOTHELIN | -3 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | ||
| CHEMBL66089 | 201790 | 12 | 125I-ENDOTHELIN | -3 | 35 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | ||
| None | 214752 | 0 | 125I-ENDOTHELIN | -10471285 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 372 | 2 | 1 | 3 | 4.4 | CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)Cl | None | ||
| 104865 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 3494 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 392 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| CHEMBL957 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| DB00559 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 104865 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 3494 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 392 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| CHEMBL957 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| DB00559 | 698 | 94 | 125I-ENDOTHELIN | -6 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| None | 214305 | 0 | 125I-ENDOTHELIN | -52 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 520 | 10 | 2 | 7 | 4.7 | CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5 | None | ||
| 3951 | 388 | 82 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | None | ||
| 4337 | 388 | 82 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | None | ||
| 6918493 | 388 | 82 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | None | ||
| CHEMBL1111 | 388 | 82 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | None | ||
| DB06403 | 388 | 82 | None | 1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 378 | 7 | 1 | 5 | 3.5 | COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1 | None | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | None | ||
| 12286 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 9703472 | ||
| 6433095 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 9703472 | ||
| CHEMBL109648 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 9703472 | ||
| DB06677 | 935 | 30 | None | -1348 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | Guide to Pharmacology | 577 | 11 | 3 | 13 | 2.4 | Cc1cnc(cc1)S(=O)(=O)Nc1c(c(nc(n1)c1cc(ncc1)c1n[nH]nn1)OCCO)Oc1ccccc1OC | 9703472 | ||
| 159594 | 518 | 38 | None | -4073 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 8676339 | ||
| 3487 | 518 | 38 | None | -4073 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 8676339 | ||
| CHEMBL9194 | 518 | 38 | None | -4073 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 8676339 | ||
| DB06199 | 518 | 38 | None | -4073 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | Guide to Pharmacology | 510 | 12 | 1 | 6 | 4.7 | CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1ccc2c(c1)OCO2)CCCC | 8676339 | ||
| 13016 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10956219 | ||
| 9843631 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10956219 | ||
| CHEMBL24461 | 663 | 9 | None | -13182 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | Guide to Pharmacology | 395 | 5 | 1 | 6 | 4.4 | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=CC=C(C=C3)C4=NC=CO4 | 10956219 | ||
| 104865 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 3494 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 392 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| CHEMBL957 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| DB00559 | 698 | 94 | None | -6 | 4 | Human | 7.1 | pKi | = | 7.1 | Binding | Guide to Pharmacology | 551 | 10 | 2 | 10 | 4.2 | OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1 | 8035319 | ||
| 1007 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| 1007 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| 16130933 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| 16130933 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| 16133819 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| 16133819 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| 3886 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| 3886 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| 56947141 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| 56947141 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| CHEMBL3188091 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 1320877 | ||||
| CHEMBL3188091 | 3584 | 0 | None | -3 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 35328566 | ||||
| 16133801 | 704 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7733918 | ||||
| 3859 | 704 | 0 | None | - | 1 | Human | 9.7 | pKi | = | 9.7 | Binding | Guide to Pharmacology | None | None | None | None | 7733918 | ||||