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 |
51353551 | 17950 | 10 | None | 1 | 3 | Human | 11.0 | pEC50 | = | 11 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | 1 | 3 | Human | 11.0 | pEC50 | = | 11 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
51353551 | 17950 | 10 | None | 1 | 3 | Human | 10.9 | pEC50 | = | 10.9 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | 1 | 3 | Human | 10.9 | pEC50 | = | 10.9 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10649606 | 49349 | 0 | None | 4 | 2 | Human | 10.9 | pEC50 | = | 10.9 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | 4 | 2 | Human | 10.9 | pEC50 | = | 10.9 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10649606 | 49349 | 0 | None | 4 | 2 | Human | 10.7 | pEC50 | = | 10.7 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | 4 | 2 | Human | 10.7 | pEC50 | = | 10.7 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44336539 | 5075 | 0 | None | 1 | 3 | Human | 10.7 | pEC50 | = | 10.7 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | 1 | 3 | Human | 10.7 | pEC50 | = | 10.7 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10819755 | 164890 | 0 | None | 218776 | 2 | Human | 10.6 | pEC50 | = | 10.6 | Functional | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL423907 | 164890 | 0 | None | 218776 | 2 | Human | 10.6 | pEC50 | = | 10.6 | Functional | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24769543 | 188119 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504406 | 188119 | 0 | None | 2 | 2 | Human | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562302 | 187608 | 0 | None | - | 1 | Human | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 666 | 11 | 2 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL498958 | 187608 | 0 | None | - | 1 | Human | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 666 | 11 | 2 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24769604 | 188104 | 0 | None | -1 | 2 | Mouse | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504114 | 188104 | 0 | None | -1 | 2 | Mouse | 10.5 | pEC50 | = | 10.5 | Functional | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
10649606 | 49349 | 0 | None | 4 | 2 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | 4 | 2 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44562297 | 188038 | 0 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | 631 | 9 | 2 | 7 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL502974 | 188038 | 0 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | 631 | 9 | 2 | 7 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
4627 | 809 | 44 | None | -1 | 6 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
864 | 809 | 44 | None | -1 | 6 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
9833444 | 809 | 44 | None | -1 | 6 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 6 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
DB09142 | 809 | 44 | None | -1 | 6 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
24861113 | 187607 | 0 | None | 24 | 2 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL498942 | 187607 | 0 | None | 24 | 2 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL506201 | 187607 | 0 | None | 24 | 2 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44336539 | 5075 | 0 | None | 1 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | 1 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
24861114 | 188550 | 3 | None | - | 1 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 582 | 7 | 1 | 6 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL510690 | 188550 | 3 | None | - | 1 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 582 | 7 | 1 | 6 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562301 | 188464 | 0 | None | 3 | 2 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL509464 | 188464 | 0 | None | 3 | 2 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861060 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446789 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504861 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861060 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL446789 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL504861 | 188141 | 0 | None | 5 | 3 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155530671 | 170996 | 0 | None | 47863 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 1627 | 65 | 14 | 19 | 4.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4464703 | 170996 | 0 | None | 47863 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 1627 | 65 | 14 | 19 | 4.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
46869398 | 61595 | 0 | None | 5 | 3 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774043 | 61595 | 0 | None | 5 | 3 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
24769605 | 178142 | 0 | None | - | 1 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL468372 | 178142 | 0 | None | - | 1 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
53233689 | 61527 | 0 | None | 2 | 3 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773877 | 61527 | 0 | None | 2 | 3 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
155524181 | 170286 | 0 | None | 4 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 1820 | 71 | 18 | 22 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4453982 | 170286 | 0 | None | 4 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 1820 | 71 | 18 | 22 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24769604 | 188104 | 0 | None | 1 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504114 | 188104 | 0 | None | 1 | 2 | Human | 10.2 | pEC50 | = | 10.2 | Functional | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562304 | 188288 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 664 | 9 | 3 | 7 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(=O)NC)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL507094 | 188288 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 664 | 9 | 3 | 7 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(=O)NC)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861394 | 188468 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 592 | 5 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL509519 | 188468 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 592 | 5 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578457 | 171904 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL448221 | 171904 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562300 | 188052 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503107 | 188052 | 0 | None | - | 1 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24769546 | 172120 | 0 | None | 2 | 2 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL450105 | 172120 | 0 | None | 2 | 2 | Human | 10.1 | pEC50 | = | 10.1 | Functional | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861391 | 188165 | 0 | None | 2 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505225 | 188165 | 0 | None | 2 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505969 | 188165 | 0 | None | 2 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
16755781 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL443189 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505409 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505727 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
16755781 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL443189 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505409 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505727 | 188199 | 10 | None | 9 | 3 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562298 | 170885 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 5.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446324 | 170885 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 667 | 10 | 2 | 8 | 5.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562312 | 188060 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503331 | 188060 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562306 | 188342 | 0 | None | 8 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL508004 | 188342 | 0 | None | 8 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562296 | 188416 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 648 | 11 | 2 | 8 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL508772 | 188416 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 648 | 11 | 2 | 8 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562307 | 172137 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10 | Functional | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL450443 | 172137 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10 | Functional | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562303 | 172219 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10 | Functional | ChEMBL | 685 | 10 | 2 | 8 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL451342 | 172219 | 0 | None | - | 1 | Human | 10.0 | pEC50 | = | 10 | Functional | ChEMBL | 685 | 10 | 2 | 8 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL386682 | 210640 | 0 | None | 60 | 2 | Guinea pig | 10.0 | pEC50 | = | 10 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN(C)C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
155535107 | 171448 | 0 | None | 323 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1904 | 73 | 19 | 22 | 4.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471525 | 171448 | 0 | None | 323 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1904 | 73 | 19 | 22 | 4.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155537344 | 171752 | 0 | None | 46773 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4475304 | 171752 | 0 | None | 46773 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155532425 | 171182 | 0 | None | 3 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4467338 | 171182 | 0 | None | 3 | 2 | Human | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.8b01558 | ||
24769546 | 172120 | 0 | None | -2 | 2 | Mouse | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL450105 | 172120 | 0 | None | -2 | 2 | Mouse | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562301 | 188464 | 0 | None | -3 | 2 | Mouse | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL509464 | 188464 | 0 | None | -3 | 2 | Mouse | 10.0 | pEC50 | = | 10.0 | Functional | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155555346 | 173800 | 0 | None | 3 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4551834 | 173800 | 0 | None | 3 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155557064 | 174020 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1998 | 75 | 18 | 24 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4557012 | 174020 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1998 | 75 | 18 | 24 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44336539 | 5075 | 0 | None | 1 | 3 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | 1 | 3 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
44578729 | 189039 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 531 | 4 | 0 | 7 | 5.1 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL514953 | 189039 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 531 | 4 | 0 | 7 | 5.1 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
53233689 | 61527 | 0 | None | -2 | 3 | Mouse | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773877 | 61527 | 0 | None | -2 | 3 | Mouse | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
155516677 | 169522 | 0 | None | 1 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1822 | 72 | 18 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4443415 | 169522 | 0 | None | 1 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1822 | 72 | 18 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155544674 | 174364 | 0 | None | 1 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4565336 | 174364 | 0 | None | 1 | 2 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578728 | 178878 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 535 | 6 | 0 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL474067 | 178878 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 535 | 6 | 0 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562299 | 188282 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 646 | 9 | 3 | 7 | 5.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL507051 | 188282 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 646 | 9 | 3 | 7 | 5.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24769543 | 188119 | 0 | None | -2 | 2 | Mouse | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504406 | 188119 | 0 | None | -2 | 2 | Mouse | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155536333 | 171606 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1865 | 71 | 17 | 24 | 1.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4473468 | 171606 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 1865 | 71 | 17 | 24 | 1.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24861392 | 172349 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 574 | 5 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL451644 | 172349 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 574 | 5 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
44562314 | 188176 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505432 | 188176 | 0 | None | - | 1 | Human | 9.9 | pEC50 | = | 9.9 | Functional | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155564421 | 174696 | 0 | None | 12302 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1770 | 69 | 16 | 21 | 3.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4572516 | 174696 | 0 | None | 12302 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1770 | 69 | 16 | 21 | 3.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155524770 | 170371 | 0 | None | 12882 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1641 | 66 | 14 | 19 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4455361 | 170371 | 0 | None | 12882 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1641 | 66 | 14 | 19 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562309 | 171016 | 0 | None | - | 1 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 603 | 8 | 2 | 7 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446502 | 171016 | 0 | None | - | 1 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 603 | 8 | 2 | 7 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155526914 | 170636 | 0 | None | 2 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1837 | 72 | 19 | 24 | 0.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4459331 | 170636 | 0 | None | 2 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1837 | 72 | 19 | 24 | 0.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155559320 | 174292 | 0 | None | 1 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1872 | 72 | 18 | 23 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4563364 | 174292 | 0 | None | 1 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1872 | 72 | 18 | 23 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155533399 | 171279 | 0 | None | -2 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1838 | 72 | 19 | 24 | 1.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4468861 | 171279 | 0 | None | -2 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1838 | 72 | 19 | 24 | 1.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155535249 | 171437 | 0 | None | 2754 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1808 | 68 | 16 | 23 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471373 | 171437 | 0 | None | 2754 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1808 | 68 | 16 | 23 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155535579 | 171484 | 0 | None | 158 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471871 | 171484 | 0 | None | 158 | 2 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562310 | 172084 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL449681 | 172084 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155552556 | 173496 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1792 | 67 | 16 | 22 | 1.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4544208 | 173496 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1792 | 67 | 16 | 22 | 1.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
51353551 | 17950 | 10 | None | 1 | 3 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | 1 | 3 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
155542488 | 172563 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1820 | 69 | 16 | 22 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4520976 | 172563 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1820 | 69 | 16 | 22 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
54583298 | 61594 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774042 | 61594 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44562308 | 172087 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL449725 | 172087 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155514270 | 169303 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL4440419 | 169303 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
155514432 | 169298 | 0 | None | 1096 | 2 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 2121 | 86 | 19 | 27 | 2.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4440303 | 169298 | 0 | None | 1096 | 2 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 2121 | 86 | 19 | 27 | 2.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155551968 | 173445 | 0 | None | 9772 | 2 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1793 | 69 | 16 | 20 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4542927 | 173445 | 0 | None | 9772 | 2 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 1793 | 69 | 16 | 20 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
54583296 | 61585 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 533 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774033 | 61585 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 533 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
155540739 | 171940 | 0 | None | 3388 | 2 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 1907 | 74 | 17 | 24 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4483457 | 171940 | 0 | None | 3388 | 2 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 1907 | 74 | 17 | 24 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578686 | 178793 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473865 | 178793 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562305 | 188035 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL502924 | 188035 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155514270 | 169303 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4440419 | 169303 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578764 | 180230 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 535 | 4 | 0 | 7 | 5.0 | O=C(c1cn(-c2ccc3c(c2)OCCO3)c(-c2ccc(F)cc2)n1)N1CCN(c2cnc3ccccc3c2)CC1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL475679 | 180230 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 535 | 4 | 0 | 7 | 5.0 | O=C(c1cn(-c2ccc3c(c2)OCCO3)c(-c2ccc(F)cc2)n1)N1CCN(c2cnc3ccccc3c2)CC1 | 10.1016/j.bmcl.2008.06.057 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
155539345 | 172264 | 0 | None | 3235 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1850 | 72 | 16 | 23 | 3.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4514283 | 172264 | 0 | None | 3235 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1850 | 72 | 16 | 23 | 3.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155543163 | 172715 | 0 | None | 8709 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1886 | 72 | 16 | 25 | 2.5 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4525615 | 172715 | 0 | None | 8709 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1886 | 72 | 16 | 25 | 2.5 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24861060 | 188141 | 0 | None | -5 | 3 | Mouse | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446789 | 188141 | 0 | None | -5 | 3 | Mouse | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504861 | 188141 | 0 | None | -5 | 3 | Mouse | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155517239 | 169590 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 2582 | 122 | 16 | 39 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4444353 | 169590 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 2582 | 122 | 16 | 39 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155547906 | 173104 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4534977 | 173104 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155546692 | 173070 | 0 | None | -3 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1861 | 72 | 19 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4534236 | 173070 | 0 | None | -3 | 2 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 1861 | 72 | 19 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
155515427 | 169382 | 0 | None | 1819 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4441596 | 169382 | 0 | None | 1819 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155566319 | 175167 | 0 | None | 4677 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1850 | 71 | 16 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4583158 | 175167 | 0 | None | 4677 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1850 | 71 | 16 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155543995 | 172751 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1876 | 73 | 16 | 22 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4526455 | 172751 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1876 | 73 | 16 | 22 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155548381 | 173160 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1720 | 69 | 15 | 20 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4536393 | 173160 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1720 | 69 | 15 | 20 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24861174 | 174035 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL455742 | 174035 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155562281 | 175268 | 0 | None | 4168 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4585323 | 175268 | 0 | None | 4168 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155555065 | 173762 | 0 | None | 4168 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4550876 | 173762 | 0 | None | 4168 | 2 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562313 | 171891 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL448118 | 171891 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
44562306 | 188342 | 0 | None | -8 | 2 | Mouse | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL508004 | 188342 | 0 | None | -8 | 2 | Mouse | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155517761 | 169656 | 0 | None | 416 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4445529 | 169656 | 0 | None | 416 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155560670 | 174520 | 0 | None | 72 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4568746 | 174520 | 0 | None | 72 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155568312 | 175504 | 0 | None | 36 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1836 | 72 | 17 | 23 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4591101 | 175504 | 0 | None | 36 | 2 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 1836 | 72 | 17 | 23 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44578727 | 189158 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515887 | 189158 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
46869398 | 61595 | 0 | None | -5 | 3 | Mouse | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774043 | 61595 | 0 | None | -5 | 3 | Mouse | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
54580295 | 61584 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774032 | 61584 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
155532759 | 171189 | 0 | None | 27542 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 1431 | 50 | 12 | 15 | 5.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4467402 | 171189 | 0 | None | 27542 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 1431 | 50 | 12 | 15 | 5.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578767 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL453083 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL503822 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578767 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL453083 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503822 | 172944 | 0 | None | 3 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
54586148 | 61539 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 543 | 4 | 0 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773891 | 61539 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 543 | 4 | 0 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44562311 | 188132 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504707 | 188132 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
51353551 | 17950 | 10 | None | 1 | 3 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | 1 | 3 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
168277247 | 190115 | 0 | None | -12 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 5585 | 206 | 67 | 76 | -9.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5182331 | 190115 | 0 | None | -12 | 2 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 5585 | 206 | 67 | 76 | -9.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
168281017 | 190320 | 0 | None | -10 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 4869 | 167 | 62 | 67 | -13.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5185239 | 190320 | 0 | None | -10 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 4869 | 167 | 62 | 67 | -13.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
155543846 | 172641 | 0 | None | -14 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 1838 | 72 | 19 | 24 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4522865 | 172641 | 0 | None | -14 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 1838 | 72 | 19 | 24 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24785705 | 181704 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478398 | 181704 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
168280134 | 190147 | 0 | None | -3 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 5585 | 206 | 67 | 76 | -9.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5182775 | 190147 | 0 | None | -3 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 5585 | 206 | 67 | 76 | -9.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)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](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
16755782 | 178771 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473663 | 178771 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578424 | 182344 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479256 | 182344 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155540394 | 172367 | 0 | None | 58 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 1820 | 69 | 17 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4516794 | 172367 | 0 | None | 58 | 2 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 1820 | 69 | 17 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
168273900 | 190104 | 0 | None | -7 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 4701 | 158 | 61 | 64 | -14.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5182173 | 190104 | 0 | None | -7 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 4701 | 158 | 61 | 64 | -14.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
168277239 | 190114 | 0 | None | -2 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 5417 | 197 | 66 | 73 | -11.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5182323 | 190114 | 0 | None | -2 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 5417 | 197 | 66 | 73 | -11.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL409529 | 211020 | 1 | None | 11 | 2 | Guinea pig | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
168276807 | 190042 | 0 | None | -9 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 5417 | 197 | 66 | 73 | -11.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
CHEMBL5181266 | 190042 | 0 | None | -9 | 2 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 5417 | 197 | 66 | 73 | -11.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.ejmech.2022.114214 | ||
54587150 | 61535 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773887 | 61535 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
16755781 | 188199 | 10 | None | -12 | 3 | Mouse | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL443189 | 188199 | 10 | None | -12 | 3 | Mouse | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505409 | 188199 | 10 | None | -12 | 3 | Mouse | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505727 | 188199 | 10 | None | -12 | 3 | Mouse | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL414592 | 211397 | 0 | None | 8 | 2 | Guinea pig | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)N(C)C(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
52949124 | 863 | 2 | None | 2 | 3 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10700916 | 173864 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4553223 | 173864 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155550911 | 173356 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 1884 | 70 | 16 | 23 | 3.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4540877 | 173356 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 1884 | 70 | 16 | 23 | 3.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
54583260 | 61544 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773896 | 61544 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
24785703 | 178772 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 534 | 6 | 0 | 5 | 6.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473664 | 178772 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 534 | 6 | 0 | 5 | 6.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
54586175 | 61589 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 504 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccoc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774037 | 61589 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 504 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccoc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44578611 | 189066 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2cccc(F)c2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515160 | 189066 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2cccc(F)c2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578456 | 189005 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5cnccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL514716 | 189005 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5cnccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155531277 | 171065 | 0 | None | 2 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 1821 | 72 | 18 | 23 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4465747 | 171065 | 0 | None | 2 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 1821 | 72 | 18 | 23 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155553502 | 173603 | 0 | None | -26 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 1822 | 72 | 19 | 22 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4547294 | 173603 | 0 | None | -26 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 1822 | 72 | 19 | 22 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155564367 | 174584 | 0 | None | -457 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 1836 | 72 | 18 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4570130 | 174584 | 0 | None | -457 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 1836 | 72 | 18 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
70691750 | 73299 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017833 | 73299 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
10507109 | 108740 | 0 | None | -51 | 4 | Guinea pig | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL321761 | 108740 | 0 | None | -51 | 4 | Guinea pig | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
70683295 | 73249 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 606 | 7 | 1 | 5 | 6.2 | O=C(CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21)N1CCC(Cc2ccccc2)C1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017692 | 73249 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 606 | 7 | 1 | 5 | 6.2 | O=C(CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21)N1CCC(Cc2ccccc2)C1 | 10.1016/j.bmcl.2012.02.049 | ||
44578531 | 171994 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 570 | 6 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OCC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL448597 | 171994 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 570 | 6 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OCC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
11571172 | 140054 | 0 | None | - | 1 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
CHEMBL381347 | 140054 | 0 | None | - | 1 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
52944224 | 17951 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 586 | 8 | 2 | 7 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269259 | 17951 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 586 | 8 | 2 | 7 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
70685411 | 73290 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 606 | 6 | 1 | 5 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017824 | 73290 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 606 | 6 | 1 | 5 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
54580296 | 61587 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774035 | 61587 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
24785432 | 180979 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 530 | 7 | 0 | 5 | 6.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(CC)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476725 | 180979 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 530 | 7 | 0 | 5 | 6.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(CC)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
52945789 | 18100 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 541 | 7 | 0 | 5 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1270487 | 18100 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 541 | 7 | 0 | 5 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
54586149 | 61542 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(C)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773894 | 61542 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(C)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL217236 | 207627 | 0 | None | 4 | 2 | Guinea pig | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
46235272 | 73298 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 589 | 8 | 1 | 7 | 4.9 | COCCC1CCCCN1C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017832 | 73298 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 589 | 8 | 1 | 7 | 4.9 | COCCC1CCCCN1C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
24785178 | 180957 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476530 | 180957 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24785177 | 189189 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1ccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL516113 | 189189 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1ccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL266839 | 208959 | 0 | None | 7 | 2 | Guinea pig | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
54580266 | 61536 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773888 | 61536 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
70689619 | 73291 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 592 | 6 | 1 | 5 | 6.5 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017825 | 73291 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 592 | 6 | 1 | 5 | 6.5 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
155557285 | 173946 | 0 | None | -295 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 1779 | 74 | 19 | 22 | 1.6 | CCCC[C@H](NC(=O)[C@H](CNC(=O)CCCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4555341 | 173946 | 0 | None | -295 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 1779 | 74 | 19 | 22 | 1.6 | CCCC[C@H](NC(=O)[C@H](CNC(=O)CCCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155553269 | 173555 | 0 | None | 53 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 1818 | 68 | 15 | 22 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N1CCC[C@@H]1C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4545970 | 173555 | 0 | None | 53 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 1818 | 68 | 15 | 22 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N1CCC[C@@H]1C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578305 | 180588 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 520 | 5 | 0 | 5 | 6.1 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476095 | 180588 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 520 | 5 | 0 | 5 | 6.1 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL208479 | 207455 | 0 | None | -30 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
CHEMBL208479 | 207455 | 0 | None | -30 | 5 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
46234969 | 73294 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 626 | 7 | 1 | 5 | 7.4 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1CC1CCCCC1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017828 | 73294 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 626 | 7 | 1 | 5 | 7.4 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1CC1CCCCC1 | 10.1016/j.bmcl.2012.02.049 | ||
54587151 | 61537 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 545 | 6 | 0 | 7 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1OC | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773889 | 61537 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 545 | 6 | 0 | 7 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1OC | 10.1016/j.bmcl.2011.03.069 | ||
101823779 | 1369 | 29 | None | -354 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
16162108 | 1369 | 29 | None | -354 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
8408 | 1369 | 29 | None | -354 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
CHEMBL4451154 | 1369 | 29 | None | -354 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
54586174 | 61586 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774034 | 61586 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL375360 | 210471 | 4 | None | -1 | 2 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O | 10.1021/jm061268p | ||||
4627 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
864 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
9833444 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
DB09142 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
4627 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
864 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
9833444 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
DB09142 | 809 | 44 | None | -1 | 6 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | None | None | None | None | 10.1021/jm050921q | ||||
51353551 | 17950 | 10 | None | 1 | 3 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269257 | 17950 | 10 | None | 1 | 3 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
54580265 | 61532 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccccc1-c1cnc(C(=O)N2CCN(c3cnc4ccccc4c3)CC2)nc1-c1ccc(C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773884 | 61532 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccccc1-c1cnc(C(=O)N2CCN(c3cnc4ccccc4c3)CC2)nc1-c1ccc(C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
52942901 | 17953 | 0 | None | 1 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269261 | 17953 | 0 | None | 1 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL382051 | 210546 | 0 | None | -331 | 5 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
CHEMBL217609 | 207634 | 0 | None | 6 | 2 | Guinea pig | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
155542545 | 172549 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 1770 | 70 | 16 | 21 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4520699 | 172549 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 1770 | 70 | 16 | 21 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL382051 | 210546 | 0 | None | -331 | 5 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
44578772 | 182214 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-c2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nn2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479063 | 182214 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-c2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nn2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
70681224 | 73295 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017829 | 73295 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
44578530 | 188101 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 556 | 5 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL504024 | 188101 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 556 | 5 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
54581261 | 61534 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773886 | 61534 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
54582288 | 61541 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773893 | 61541 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
54580263 | 61528 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(F)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773878 | 61528 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(F)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
70695934 | 73297 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 595 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017831 | 73297 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 595 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
9960432 | 39187 | 6 | None | -3 | 3 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL147186 | 39187 | 6 | None | -3 | 3 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
10698109 | 106812 | 0 | None | -2 | 3 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL317181 | 106812 | 0 | None | -2 | 3 | Guinea pig | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
44578647 | 178748 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2c(F)cccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473457 | 178748 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2c(F)cccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
70695922 | 73248 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 558 | 6 | 1 | 5 | 5.9 | CCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017691 | 73248 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 558 | 6 | 1 | 5 | 5.9 | CCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
54581301 | 61590 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 503 | 5 | 1 | 5 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5cc[nH]c5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774038 | 61590 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 503 | 5 | 1 | 5 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5cc[nH]c5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
54586147 | 61533 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773885 | 61533 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
70693814 | 73296 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccncc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017830 | 73296 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccncc1 | 10.1016/j.bmcl.2012.02.049 | ||
52946666 | 17952 | 0 | None | 2 | 2 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269260 | 17952 | 0 | None | 2 | 2 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
44578422 | 180980 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5n4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476739 | 180980 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5n4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
52949124 | 863 | 2 | None | -2 | 3 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
9055 | 863 | 2 | None | -2 | 3 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 3 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
DB12694 | 863 | 2 | None | -2 | 3 | Rat | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
44578562 | 180952 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc3c2OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476519 | 180952 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc3c2OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
52940616 | 17955 | 0 | None | 1 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269263 | 17955 | 0 | None | 1 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
46234820 | 73292 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 572 | 6 | 1 | 5 | 6.1 | CC(C)C1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017826 | 73292 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 572 | 6 | 1 | 5 | 6.1 | CC(C)C1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
24785180 | 180958 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 536 | 6 | 0 | 5 | 6.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476531 | 180958 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 536 | 6 | 0 | 5 | 6.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
54582313 | 61591 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc2ccccc2cc1N1CCN(C(=O)c2ncc(-c3ccc(OC)cc3)c(-c3ccc(C)cc3)n2)CC1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774039 | 61591 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc2ccccc2cc1N1CCN(C(=O)c2ncc(-c3ccc(OC)cc3)c(-c3ccc(C)cc3)n2)CC1 | 10.1016/j.bmcl.2011.03.069 | ||
70689603 | 73247 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 588 | 8 | 1 | 6 | 5.5 | COCCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017690 | 73247 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 588 | 8 | 1 | 6 | 5.5 | COCCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
52940616 | 17955 | 0 | None | -1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269263 | 17955 | 0 | None | -1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
24785430 | 181702 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 530 | 6 | 0 | 5 | 6.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(C)C)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478397 | 181702 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 530 | 6 | 0 | 5 | 6.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(C)C)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL269185 | 209035 | 0 | None | 5 | 2 | Guinea pig | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)NCC(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
44578398 | 181202 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc5ccccc45)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL477784 | 181202 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc5ccccc45)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
70695933 | 73289 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 607 | 7 | 1 | 6 | 5.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017823 | 73289 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 607 | 7 | 1 | 6 | 5.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
54583297 | 61592 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774040 | 61592 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
54582287 | 61540 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 501 | 5 | 0 | 6 | 5.3 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773892 | 61540 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 501 | 5 | 0 | 6 | 5.3 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
24785431 | 189218 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL516355 | 189218 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24784941 | 189126 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 516 | 6 | 0 | 5 | 6.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515616 | 189126 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 516 | 6 | 0 | 5 | 6.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL2370248 | 208069 | 0 | None | -1 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00093a013 | ||||
155540415 | 172370 | 0 | None | -1584 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 1862 | 71 | 17 | 23 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4516868 | 172370 | 0 | None | -1584 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 1862 | 71 | 17 | 23 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
54580267 | 61543 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 535 | 5 | 0 | 6 | 6.0 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2Cl)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773895 | 61543 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 535 | 5 | 0 | 6 | 6.0 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2Cl)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
52943046 | 17954 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 557 | 8 | 0 | 6 | 5.8 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Oc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269262 | 17954 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 557 | 8 | 0 | 6 | 5.8 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Oc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
51353551 | 17950 | 10 | None | -18 | 3 | Rat | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269257 | 17950 | 10 | None | -18 | 3 | Rat | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
52946666 | 17952 | 0 | None | -2 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269260 | 17952 | 0 | None | -2 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
24785176 | 180981 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 500 | 5 | 0 | 4 | 6.5 | CCc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476747 | 180981 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 500 | 5 | 0 | 4 | 6.5 | CCc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
70683305 | 73300 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 635 | 7 | 1 | 6 | 6.4 | Cc1cccc(CC2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017834 | 73300 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 635 | 7 | 1 | 6 | 6.4 | Cc1cccc(CC2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
46235271 | 73301 | 2 | None | 3 | 3 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 3 | 3 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
24785179 | 180954 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 502 | 6 | 0 | 5 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476520 | 180954 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 502 | 6 | 0 | 5 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
54584255 | 61588 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774036 | 61588 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44578251 | 181850 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478604 | 181850 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578423 | 189067 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515161 | 189067 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155533520 | 171262 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 910 | 26 | 8 | 9 | 2.5 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4468598 | 171262 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 910 | 26 | 8 | 9 | 2.5 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24784942 | 180761 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 488 | 4 | 1 | 5 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(O)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476297 | 180761 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 488 | 4 | 1 | 5 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(O)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
46234970 | 73293 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 620 | 7 | 1 | 5 | 6.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017827 | 73293 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 620 | 7 | 1 | 5 | 6.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
136000594 | 61538 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 517 | 4 | 2 | 7 | 5.0 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc(O)c(O)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773890 | 61538 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 517 | 4 | 2 | 7 | 5.0 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc(O)c(O)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44578399 | 181372 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 492 | 5 | 1 | 6 | 4.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4nc5ccccc5[nH]4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL477996 | 181372 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 492 | 5 | 1 | 6 | 4.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4nc5ccccc5[nH]4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
10509945 | 88954 | 0 | None | 63 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL2369816 | 88954 | 0 | None | 63 | 2 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578455 | 181873 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478630 | 181873 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24784940 | 182205 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479046 | 182205 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
54581302 | 61593 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc(N2CCN(C(=O)c3ncc(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774041 | 61593 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc(N2CCN(C(=O)c3ncc(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2011.03.069 | ||
44336539 | 5075 | 0 | None | 1 | 3 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | 1 | 3 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
52942901 | 17953 | 0 | None | -1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269261 | 17953 | 0 | None | -1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
155517868 | 169644 | 0 | None | -457 | 2 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 1893 | 76 | 19 | 24 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4445353 | 169644 | 0 | None | -457 | 2 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 1893 | 76 | 19 | 24 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44578529 | 182192 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 530 | 7 | 0 | 5 | 6.8 | CCCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479030 | 182192 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 530 | 7 | 0 | 5 | 6.8 | CCCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
443375 | 205872 | 40 | None | 2 | 6 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00067a001 | ||
CHEMBL9506 | 205872 | 40 | None | 2 | 6 | Human | 10.1 | pIC50 | = | 10.1 | Functional | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00067a001 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
3035433 | 99009 | 12 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 535 | 4 | 3 | 7 | 3.1 | CC(C)C[C@@H]1N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/jm00067a001 | ||
CHEMBL283117 | 99009 | 12 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 535 | 4 | 3 | 7 | 3.1 | CC(C)C[C@@H]1N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/jm00067a001 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10507071 | 113111 | 0 | None | -524 | 4 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL332261 | 113111 | 0 | None | -524 | 4 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL375360 | 210471 | 4 | None | -1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O | 10.1021/jm061268p | ||||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11027990 | 67192 | 0 | None | -100 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | -100 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44398261 | 123867 | 0 | None | -91 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | -91 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | -7 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | -7 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44306887 | 101591 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL302027 | 101591 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
44306360 | 157333 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL408395 | 157333 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
44458112 | 98254 | 0 | None | - | 1 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL277661 | 98254 | 0 | None | - | 1 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
44306888 | 101860 | 0 | None | - | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL303635 | 101860 | 0 | None | - | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
44306868 | 101613 | 0 | None | - | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 836 | 18 | 9 | 7 | 3.7 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL302150 | 101613 | 0 | None | - | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 836 | 18 | 9 | 7 | 3.7 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
2360 | 3245 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Drug Central | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | None | ||
5042 | 3245 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Drug Central | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | None | ||
871 | 3245 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Drug Central | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | None | ||
CHEMBL1697771 | 3245 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Drug Central | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | None | ||
DB11656 | 3245 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Drug Central | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | None | ||
1614 | 2317 | 60 | None | -1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
60182 | 2317 | 60 | None | -1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
892 | 2317 | 60 | None | -1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
CHEMBL206025 | 2317 | 60 | None | -1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
65937 | 1376 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
834 | 1376 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
889 | 1376 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
CHEMBL550781 | 1376 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
DB04856 | 1376 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
4329839 | 806 | 0 | None | -158 | 2 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
861 | 806 | 0 | None | -158 | 2 | Rat | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
16168172 | 1742 | 0 | None | -158 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
3559 | 1742 | 0 | None | -158 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
444007 | 2994 | 0 | None | -794 | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
870 | 2994 | 0 | None | -794 | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
DB00183 | 2994 | 0 | None | -794 | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
3960 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 1975695 | ||
3960 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 2437574 | ||
891 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 1975695 | ||
891 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 2437574 | ||
CHEMBL24938 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 1975695 | ||
CHEMBL24938 | 2313 | 20 | None | 53 | 4 | Rat | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 2437574 | ||
52949124 | 863 | 2 | None | 2 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 20851601 | ||
9055 | 863 | 2 | None | 2 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 20851601 | ||
CHEMBL1269258 | 863 | 2 | None | 2 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 20851601 | ||
DB12694 | 863 | 2 | None | 2 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | Guide to Pharmacology | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 20851601 | ||
5311148 | 1865 | 5 | None | 41 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 9276016 | ||
865 | 1865 | 5 | None | 41 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 9276016 | ||
CHEMBL293226 | 1865 | 5 | None | 41 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 9276016 | ||
3888 | 2091 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | None | None | None | None | 7654246 | ||||
5311196 | 2091 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | None | None | None | None | 7654246 | ||||
122077 | 2291 | 45 | None | -8 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10988332 | ||
890 | 2291 | 45 | None | -8 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10988332 | ||
CHEMBL249973 | 2291 | 45 | None | -8 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10988332 | ||
DB04867 | 2291 | 45 | None | -8 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10988332 | ||
121964 | 205 | 28 | None | 4265 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 1636779 | ||||
858 | 205 | 28 | None | 4265 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 1636779 | ||||
CHEMBL323521 | 205 | 28 | None | 4265 | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | None | None | None | None | 1636779 | ||||
904 | 2977 | 7 | None | 3 | 3 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 8605955 | ||
9915756 | 2977 | 7 | None | 3 | 3 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 8605955 | ||
CHEMBL2111204 | 2977 | 7 | None | 3 | 3 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 8605955 | ||
CHEMBL356898 | 2977 | 7 | None | 3 | 3 | Rat | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 8605955 | ||
862 | 807 | 0 | None | -1 | 2 | Mouse | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | None | None | None | None | 12370550 | ||||
127948 | 3662 | 0 | None | 79432 | 2 | Rat | 9.6 | pIC50 | = | 9.6 | Functional | Guide to Pharmacology | 502 | 7 | 2 | 4 | 4.5 | COc1ccc2c(c1)N(c1ccccc1F)C(=O)[C@@]2(CCC(=O)O)NC(=O)C1CCc2c(C1)cccc2 | 8813597 | ||
884 | 3662 | 0 | None | 79432 | 2 | Rat | 9.6 | pIC50 | = | 9.6 | Functional | Guide to Pharmacology | 502 | 7 | 2 | 4 | 4.5 | COc1ccc2c(c1)N(c1ccccc1F)C(=O)[C@@]2(CCC(=O)O)NC(=O)C1CCc2c(C1)cccc2 | 8813597 | ||
3476 | 1373 | 8 | None | 870 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
59751 | 1373 | 8 | None | 870 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
878 | 1373 | 8 | None | 870 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
CHEMBL39263 | 1373 | 8 | None | 870 | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Functional | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
4627 | 809 | 44 | None | -2 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
864 | 809 | 44 | None | -2 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
9833444 | 809 | 44 | None | -2 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
DB09142 | 809 | 44 | None | -2 | 6 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
2281 | 3126 | 76 | None | -2454 | 2 | Rat | 2.2 | pIC50 | None | 2.2 | Functional | Guide to Pharmacology | 334 | 10 | 2 | 3 | 2.3 | CCCN(C(=O)C(NC(=O)c1ccccc1)CCC(=O)O)CCC | 3440035 | ||
4922 | 3126 | 76 | None | -2454 | 2 | Rat | 2.2 | pIC50 | None | 2.2 | Functional | Guide to Pharmacology | 334 | 10 | 2 | 3 | 2.3 | CCCN(C(=O)C(NC(=O)c1ccccc1)CCC(=O)O)CCC | 3440035 | ||
893 | 3126 | 76 | None | -2454 | 2 | Rat | 2.2 | pIC50 | None | 2.2 | Functional | Guide to Pharmacology | 334 | 10 | 2 | 3 | 2.3 | CCCN(C(=O)C(NC(=O)c1ccccc1)CCC(=O)O)CCC | 3440035 | ||
CHEMBL316561 | 3126 | 76 | None | -2454 | 2 | Rat | 2.2 | pIC50 | None | 2.2 | Functional | Guide to Pharmacology | 334 | 10 | 2 | 3 | 2.3 | CCCN(C(=O)C(NC(=O)c1ccccc1)CCC(=O)O)CCC | 3440035 | ||
DB13431 | 3126 | 76 | None | -2454 | 2 | Rat | 2.2 | pIC50 | None | 2.2 | Functional | Guide to Pharmacology | 334 | 10 | 2 | 3 | 2.3 | CCCN(C(=O)C(NC(=O)c1ccccc1)CCC(=O)O)CCC | 3440035 | ||
2360 | 3245 | 0 | None | - | 1 | Rat | 4.4 | pIC50 | None | 4.4 | Functional | Guide to Pharmacology | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | 15556137 | ||
5042 | 3245 | 0 | None | - | 1 | Rat | 4.4 | pIC50 | None | 4.4 | Functional | Guide to Pharmacology | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | 15556137 | ||
871 | 3245 | 0 | None | - | 1 | Rat | 4.4 | pIC50 | None | 4.4 | Functional | Guide to Pharmacology | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | 15556137 | ||
CHEMBL1697771 | 3245 | 0 | None | - | 1 | Rat | 4.4 | pIC50 | None | 4.4 | Functional | Guide to Pharmacology | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | 15556137 | ||
DB11656 | 3245 | 0 | None | - | 1 | Rat | 4.4 | pIC50 | None | 4.4 | Functional | Guide to Pharmacology | 370 | 5 | 3 | 3 | 2.6 | Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2 | 15556137 | ||
108187 | 913 | 30 | None | -794 | 5 | Rat | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 1975695 | ||
873 | 913 | 30 | None | -794 | 5 | Rat | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 1975695 | ||
CHEMBL2062154 | 913 | 30 | None | -794 | 5 | Rat | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 1975695 | ||
CHEMBL287735 | 913 | 30 | None | -794 | 5 | Rat | 5.6 | pIC50 | None | 5.6 | Functional | Guide to Pharmacology | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 1975695 | ||
122119 | 2974 | 0 | None | -1000 | 2 | Rat | 5.9 | pIC50 | None | 5.9 | Functional | Guide to Pharmacology | 618 | 12 | 5 | 6 | 5.1 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](CC1CNc2c1cccc2)(NC(=O)OC1C[C@H]2C([C@]1(C)CC2)(C)C)C)CCC(=O)O | 1975695 | ||
882 | 2974 | 0 | None | -1000 | 2 | Rat | 5.9 | pIC50 | None | 5.9 | Functional | Guide to Pharmacology | 618 | 12 | 5 | 6 | 5.1 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](CC1CNc2c1cccc2)(NC(=O)OC1C[C@H]2C([C@]1(C)CC2)(C)C)C)CCC(=O)O | 1975695 | ||
880 | 2208 | 3 | None | -7413 | 2 | Rat | 6.4 | pIC50 | None | 6.4 | Functional | Guide to Pharmacology | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 8632408 | ||
9935175 | 2208 | 3 | None | -7413 | 2 | Rat | 6.4 | pIC50 | None | 6.4 | Functional | Guide to Pharmacology | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 8632408 | ||
CHEMBL2093059 | 2208 | 3 | None | -7413 | 2 | Rat | 6.4 | pIC50 | None | 6.4 | Functional | Guide to Pharmacology | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 8632408 | ||
1614 | 2317 | 60 | None | -1 | 2 | Rat | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 3663268 | ||
60182 | 2317 | 60 | None | -1 | 2 | Rat | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 3663268 | ||
892 | 2317 | 60 | None | -1 | 2 | Rat | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 3663268 | ||
CHEMBL206025 | 2317 | 60 | None | -1 | 2 | Rat | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 3663268 | ||
104929 | 2189 | 8 | None | -12 | 3 | Rat | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
3477 | 2189 | 8 | None | -12 | 3 | Rat | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
879 | 2189 | 8 | None | -12 | 3 | Rat | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
CHEMBL289498 | 2189 | 8 | None | -12 | 3 | Rat | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 1975695 | ||
10742947 | 3936 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | None | 6.7 | Functional | Guide to Pharmacology | 469 | 8 | 6 | 4 | 3.7 | OC(=O)CC(c1ccccc1)NC(=O)c1cccc(c1)NC(=O)c1cc2c([nH]1)ccc(c2)C(=N)N | 12538004 | ||
886 | 3936 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | None | 6.7 | Functional | Guide to Pharmacology | 469 | 8 | 6 | 4 | 3.7 | OC(=O)CC(c1ccccc1)NC(=O)c1cccc(c1)NC(=O)c1cc2c([nH]1)ccc(c2)C(=N)N | 12538004 | ||
CHEMBL137814 | 3936 | 0 | None | - | 1 | Rat | 6.7 | pIC50 | None | 6.7 | Functional | Guide to Pharmacology | 469 | 8 | 6 | 4 | 3.7 | OC(=O)CC(c1ccccc1)NC(=O)c1cccc(c1)NC(=O)c1cc2c([nH]1)ccc(c2)C(=N)N | 12538004 | ||
887 | 4047 | 24 | None | -2511 | 3 | Rat | 6.9 | pIC50 | None | 6.9 | Functional | Guide to Pharmacology | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 9022799 | ||
9870520 | 4047 | 24 | None | -2511 | 3 | Rat | 6.9 | pIC50 | None | 6.9 | Functional | Guide to Pharmacology | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 9022799 | ||
CHEMBL324547 | 4047 | 24 | None | -2511 | 3 | Rat | 6.9 | pIC50 | None | 6.9 | Functional | Guide to Pharmacology | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 9022799 | ||
DB12355 | 4047 | 24 | None | -2511 | 3 | Rat | 6.9 | pIC50 | None | 6.9 | Functional | Guide to Pharmacology | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 9022799 | ||
4627 | 809 | 44 | None | -2 | 6 | Rat | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
864 | 809 | 44 | None | -2 | 6 | Rat | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
9833444 | 809 | 44 | None | -2 | 6 | Rat | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 6 | Rat | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
DB09142 | 809 | 44 | None | -2 | 6 | Rat | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | None | None | None | None | 1975695 | ||||
10348659 | 1774 | 0 | None | 3 | 2 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 8558528 | ||
866 | 1774 | 0 | None | 3 | 2 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 8558528 | ||
CHEMBL1184355 | 1774 | 0 | None | 3 | 2 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 8558528 | ||
19023535 | 3484 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | None | 7.8 | Functional | Guide to Pharmacology | 363 | 4 | 3 | 3 | 2.0 | OC(=O)C1CN(C(=O)C1NC(=O)c1c[nH]c2c1cccc2)c1ccccc1 | None | ||
883 | 3484 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | None | 7.8 | Functional | Guide to Pharmacology | 363 | 4 | 3 | 3 | 2.0 | OC(=O)C1CN(C(=O)C1NC(=O)c1c[nH]c2c1cccc2)c1ccccc1 | None | ||
11757476 | 2033 | 1 | None | - | 1 | Rat | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 15331911 | ||
876 | 2033 | 1 | None | - | 1 | Rat | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 15331911 | ||
CHEMBL2112828 | 2033 | 1 | None | - | 1 | Rat | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 15331911 | ||
868 | 3610 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | 609 | 10 | 2 | 7 | 7.9 | COc1cc(Cl)c(cc1c1nc(sc1CCC1CCCCC1)NC(=O)c1cc2c(n1CC(=O)O)c(C)cc(c2)C)OC | 10215648 | ||
9852833 | 3610 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | 609 | 10 | 2 | 7 | 7.9 | COc1cc(Cl)c(cc1c1nc(sc1CCC1CCCCC1)NC(=O)c1cc2c(n1CC(=O)O)c(C)cc(c2)C)OC | 10215648 | ||
CHEMBL3302616 | 3610 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | 609 | 10 | 2 | 7 | 7.9 | COc1cc(Cl)c(cc1c1nc(sc1CCC1CCCCC1)NC(=O)c1cc2c(n1CC(=O)O)c(C)cc(c2)C)OC | 10215648 | ||
132916 | 3112 | 11 | None | 602 | 2 | Rat | 9.4 | pIC50 | None | 9.4 | Functional | Guide to Pharmacology | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 7509389 | ||
874 | 3112 | 11 | None | 602 | 2 | Rat | 9.4 | pIC50 | None | 9.4 | Functional | Guide to Pharmacology | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 7509389 | ||
CHEMBL300072 | 3112 | 11 | None | 602 | 2 | Rat | 9.4 | pIC50 | None | 9.4 | Functional | Guide to Pharmacology | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 7509389 | ||
122077 | 2291 | 45 | None | 8 | 2 | Rat | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 7681406 | ||
890 | 2291 | 45 | None | 8 | 2 | Rat | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 7681406 | ||
CHEMBL249973 | 2291 | 45 | None | 8 | 2 | Rat | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 7681406 | ||
DB04867 | 2291 | 45 | None | 8 | 2 | Rat | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 7681406 |
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 |
4627 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pEC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pEC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pEC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pEC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pEC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
10032955 | 167472 | 0 | None | - | 0 | Human | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL432256 | 167472 | 0 | None | - | 0 | Human | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL319438 | 209471 | 0 | None | - | 0 | Human | 8.4 | pEC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00017a022 | ||||
24769604 | 188104 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11 | Binding | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504114 | 188104 | 0 | None | - | 0 | Human | 11.0 | pIC50 | = | 11 | Binding | ChEMBL | 663 | 9 | 2 | 7 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562301 | 188464 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL509464 | 188464 | 0 | None | - | 0 | Human | 10.8 | pIC50 | = | 10.8 | Binding | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24769546 | 172120 | 0 | None | - | 0 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL450105 | 172120 | 0 | None | - | 0 | Human | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 618 | 9 | 2 | 8 | 4.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861391 | 188165 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505225 | 188165 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505969 | 188165 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 578 | 5 | 1 | 7 | 5.3 | O=C(O)c1cc(N2CCN(C(=O)c3cn(-c4ccc5c(c4)OCCO5)c(-c4ccc(F)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2008.06.057 | ||
24861394 | 188468 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 592 | 5 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL509519 | 188468 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 592 | 5 | 1 | 7 | 5.6 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
53233689 | 61527 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773877 | 61527 | 0 | None | - | 0 | Human | 10.5 | pIC50 | = | 10.5 | Binding | ChEMBL | 604 | 5 | 1 | 7 | 5.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)c(F)c1 | 10.1016/j.bmcl.2011.03.069 | ||
44562306 | 188342 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL508004 | 188342 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861060 | 188141 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446789 | 188141 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504861 | 188141 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155543995 | 172751 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 1876 | 73 | 16 | 22 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4526455 | 172751 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 1876 | 73 | 16 | 22 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562302 | 187608 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 666 | 11 | 2 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL498958 | 187608 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 666 | 11 | 2 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155562281 | 175268 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4585323 | 175268 | 0 | None | - | 0 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10819755 | 164890 | 0 | None | - | 2 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL423907 | 164890 | 0 | None | - | 2 | Human | 10.4 | pIC50 | = | 10.4 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL411079 | 211115 | 0 | None | - | 0 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N1CSC(C)(C)[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
121964 | 205 | 28 | None | 831 | 2 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
858 | 205 | 28 | None | 831 | 2 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
CHEMBL323521 | 205 | 28 | None | 831 | 2 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
155543163 | 172715 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1886 | 72 | 16 | 25 | 2.5 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4525615 | 172715 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1886 | 72 | 16 | 25 | 2.5 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24769605 | 178142 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL468372 | 178142 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 605 | 10 | 1 | 8 | 5.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155514270 | 169303 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4440419 | 169303 | 0 | None | - | 0 | Human | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24769543 | 188119 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504406 | 188119 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 649 | 9 | 2 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861060 | 188141 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL446789 | 188141 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL504861 | 188141 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 578 | 7 | 1 | 6 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155539345 | 172264 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 1850 | 72 | 16 | 23 | 3.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4514283 | 172264 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 1850 | 72 | 16 | 23 | 3.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155514432 | 169298 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 2121 | 86 | 19 | 27 | 2.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4440303 | 169298 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 2121 | 86 | 19 | 27 | 2.3 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)[C@H](CCCCN)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155540739 | 171940 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 1907 | 74 | 17 | 24 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4483457 | 171940 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 1907 | 74 | 17 | 24 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562303 | 172219 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 685 | 10 | 2 | 8 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL451342 | 172219 | 0 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 685 | 10 | 2 | 8 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24861114 | 188550 | 3 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 582 | 7 | 1 | 6 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL510690 | 188550 | 3 | None | - | 0 | Human | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 582 | 7 | 1 | 6 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
155515427 | 169382 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4441596 | 169382 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155566319 | 175167 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1850 | 71 | 16 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4583158 | 175167 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1850 | 71 | 16 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155559320 | 174292 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1872 | 72 | 18 | 23 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4563364 | 174292 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1872 | 72 | 18 | 23 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
155547906 | 173104 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4534977 | 173104 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155560670 | 174520 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4568746 | 174520 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1886 | 72 | 17 | 23 | 4.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm020424z | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm020424z | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000937a | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000937a | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00609-9 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00164a020 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00164a020 | ||
443375 | 205872 | 40 | None | -2 | 5 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/np9800102 | ||
CHEMBL9506 | 205872 | 40 | None | -2 | 5 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/np9800102 | ||
24861113 | 187607 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL498942 | 187607 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL506201 | 187607 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 564 | 7 | 1 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562297 | 188038 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 631 | 9 | 2 | 7 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL502974 | 188038 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 631 | 9 | 2 | 7 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562299 | 188282 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 646 | 9 | 3 | 7 | 5.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL507051 | 188282 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 646 | 9 | 3 | 7 | 5.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
155536333 | 171606 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1865 | 71 | 17 | 24 | 1.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4473468 | 171606 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1865 | 71 | 17 | 24 | 1.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155555346 | 173800 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4551834 | 173800 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155535579 | 171484 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471871 | 171484 | 0 | None | - | 0 | Human | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44398261 | 123867 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10460766 | 114957 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010898i | ||
CHEMBL3350858 | 114957 | 0 | None | - | 0 | Rat | 10.1 | pIC50 | = | 10.1 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010898i | ||
44562304 | 188288 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 664 | 9 | 3 | 7 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(=O)NC)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL507094 | 188288 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 664 | 9 | 3 | 7 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@H]3CNC(=O)NC)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155555065 | 173762 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4550876 | 173762 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1836 | 71 | 17 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL269098 | 209033 | 0 | None | - | 0 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(01)81250-6 | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00092a007 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00092a007 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00092a007 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00092a007 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00092a007 | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00105a062 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00105a062 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00105a062 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00105a062 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00105a062 | ||||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00105a062 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00105a062 | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80687-3 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80687-3 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80687-3 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80687-3 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80687-3 | ||||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80687-3 | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00057a005 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00057a005 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00057a005 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00057a005 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00057a005 | ||||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00057a005 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 10.0 | pIC50 | = | 10 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00057a005 | ||
155532759 | 171189 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1431 | 50 | 12 | 15 | 5.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4467402 | 171189 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 1431 | 50 | 12 | 15 | 5.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155517239 | 169590 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 2582 | 122 | 16 | 39 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4444353 | 169590 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 2582 | 122 | 16 | 39 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562300 | 188052 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503107 | 188052 | 0 | None | - | 0 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | 645 | 9 | 2 | 7 | 6.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 10.0 | pIC50 | = | 10.0 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
155517761 | 169656 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4445529 | 169656 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 1900 | 71 | 16 | 23 | 4.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
72548703 | 161019 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | ||
CHEMBL4128926 | 161019 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | ||
44562298 | 170885 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 5.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446324 | 170885 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 667 | 10 | 2 | 8 | 5.0 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44578764 | 180230 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 535 | 4 | 0 | 7 | 5.0 | O=C(c1cn(-c2ccc3c(c2)OCCO3)c(-c2ccc(F)cc2)n1)N1CCN(c2cnc3ccccc3c2)CC1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL475679 | 180230 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 535 | 4 | 0 | 7 | 5.0 | O=C(c1cn(-c2ccc3c(c2)OCCO3)c(-c2ccc(F)cc2)n1)N1CCN(c2cnc3ccccc3c2)CC1 | 10.1016/j.bmcl.2008.06.057 | ||
16755781 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
16755781 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL443189 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL443189 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505409 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505409 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505727 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL505727 | 188199 | 10 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 560 | 7 | 1 | 6 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | ||||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.11.014 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.11.014 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.11.014 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.11.014 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.11.014 | ||||
44578457 | 171904 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL448221 | 171904 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24861392 | 172349 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 574 | 5 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL451644 | 172349 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 574 | 5 | 1 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
44562296 | 188416 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 648 | 11 | 2 | 8 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL508772 | 188416 | 0 | None | - | 0 | Human | 9.9 | pIC50 | = | 9.9 | Binding | ChEMBL | 648 | 11 | 2 | 8 | 5.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)C[C@@H]3COCC(=O)O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155552556 | 173496 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1792 | 67 | 16 | 22 | 1.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4544208 | 173496 | 0 | None | - | 0 | Human | 9.8 | pIC50 | = | 9.8 | Binding | ChEMBL | 1792 | 67 | 16 | 22 | 1.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
54586148 | 61539 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 543 | 4 | 0 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773891 | 61539 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 543 | 4 | 0 | 7 | 5.4 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
155542488 | 172563 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 1820 | 69 | 16 | 22 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4520976 | 172563 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 1820 | 69 | 16 | 22 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL413654 | 211331 | 0 | None | - | 2 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00378a012 | ||||
13822923 | 193148 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 450 | 3 | 2 | 5 | 4.5 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=NC2NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00396a028 | ||
CHEMBL53907 | 193148 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 450 | 3 | 2 | 5 | 4.5 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=NC2NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00396a028 | ||
44578729 | 189039 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 4 | 0 | 7 | 5.1 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL514953 | 189039 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 531 | 4 | 0 | 7 | 5.1 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
44562310 | 172084 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL449681 | 172084 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
46869398 | 61595 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774043 | 61595 | 0 | None | - | 0 | Human | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 576 | 6 | 1 | 6 | 6.1 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44578728 | 178878 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 535 | 6 | 0 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL474067 | 178878 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 535 | 6 | 0 | 6 | 5.9 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44562305 | 188035 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL502924 | 188035 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44562314 | 188176 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL505432 | 188176 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 602 | 8 | 1 | 7 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3C(=O)NC(C)C)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155516677 | 169522 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1822 | 72 | 18 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4443415 | 169522 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1822 | 72 | 18 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155524181 | 170286 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1820 | 71 | 18 | 22 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4453982 | 170286 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1820 | 71 | 18 | 22 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
14888734 | 167283 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1012 | 29 | 10 | 13 | 0.8 | CSCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL430906 | 167283 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1012 | 29 | 10 | 13 | 0.8 | CSCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
44562307 | 172137 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL450443 | 172137 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
54583296 | 61585 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774033 | 61585 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 533 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
10477146 | 78104 | 1 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2111920 | 78104 | 1 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
155568312 | 175504 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1836 | 72 | 17 | 23 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4591101 | 175504 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1836 | 72 | 17 | 23 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155544674 | 174364 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4565336 | 174364 | 0 | None | - | 0 | Human | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80680-0 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80680-0 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80680-0 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80680-0 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80680-0 | ||||
14208286 | 67342 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 395 | 4 | 1 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)/C=C/c2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907661 | 67342 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 395 | 4 | 1 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)/C=C/c2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
155537344 | 171752 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4475304 | 171752 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1848 | 72 | 16 | 22 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155535107 | 171448 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1904 | 73 | 19 | 22 | 4.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471525 | 171448 | 0 | None | - | 0 | Human | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 1904 | 73 | 19 | 22 | 4.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00017a022 | ||||
14208241 | 67409 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL1907852 | 67409 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
44562312 | 188060 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503331 | 188060 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 588 | 8 | 1 | 7 | 5.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
14208244 | 58560 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL168852 | 58560 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00001a027 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00001a027 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00001a027 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00001a027 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00001a027 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00173a006 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00173a006 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00173a006 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00173a006 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00173a006 | ||||
24785705 | 181704 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478398 | 181704 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2ccc3c(c2)OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
44562308 | 172087 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL449725 | 172087 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
44578767 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578767 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL453083 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL453083 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL503822 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL503822 | 172944 | 0 | None | - | 0 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 517 | 6 | 0 | 6 | 5.8 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
6957640 | 158814 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
CHEMBL410035 | 158814 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
44396718 | 67062 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 530 | 7 | 2 | 5 | 4.6 | C[C@@H]1C(=O)N(Cc2ccccc2)C(=O)N2CCC[C@H](N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OC(C)(C)C)C12 | 10.1021/jm0498755 | ||
CHEMBL188808 | 67062 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 530 | 7 | 2 | 5 | 4.6 | C[C@@H]1C(=O)N(Cc2ccccc2)C(=O)N2CCC[C@H](N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OC(C)(C)C)C12 | 10.1021/jm0498755 | ||
44562311 | 188132 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL504707 | 188132 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 589 | 8 | 0 | 8 | 5.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3COC(C)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
155557064 | 174020 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1998 | 75 | 18 | 24 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4557012 | 174020 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1998 | 75 | 18 | 24 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
443375 | 205872 | 40 | None | -2 | 5 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm701575k | ||
CHEMBL9506 | 205872 | 40 | None | -2 | 5 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm701575k | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00079a003 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00079a003 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00079a003 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00079a003 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00079a003 | ||||
6918156 | 96839 | 2 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL269016 | 96839 | 2 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
6918156 | 96839 | 2 | None | - | 0 | Guinea pig | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL269016 | 96839 | 2 | None | - | 0 | Guinea pig | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
155530671 | 170996 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1627 | 65 | 14 | 19 | 4.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4464703 | 170996 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1627 | 65 | 14 | 19 | 4.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
155524770 | 170371 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1641 | 66 | 14 | 19 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4455361 | 170371 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 1641 | 66 | 14 | 19 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)NC(=O)Cc1ccc(O)cc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44562309 | 171016 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 603 | 8 | 2 | 7 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL446502 | 171016 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 603 | 8 | 2 | 7 | 5.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@@H]3CNC(=O)NC)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
24785703 | 178772 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 534 | 6 | 0 | 5 | 6.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473664 | 178772 | 0 | None | - | 0 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 534 | 6 | 0 | 5 | 6.5 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
122077 | 2291 | 45 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10.1016/j.bmcl.2007.09.093 | ||
890 | 2291 | 45 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249973 | 2291 | 45 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10.1016/j.bmcl.2007.09.093 | ||
DB04867 | 2291 | 45 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 411 | 5 | 2 | 5 | 4.8 | OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl | 10.1016/j.bmcl.2007.09.093 | ||
44578727 | 189158 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515887 | 189158 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
10008654 | 127094 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10008654 | 127094 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL366344 | 127094 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL438773 | 212049 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
10482714 | 78022 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 551 | 6 | 3 | 5 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(C3CCCCC3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL2111545 | 78022 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 551 | 6 | 3 | 5 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(C3CCCCC3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL2370122 | 208042 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
44578686 | 178793 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473865 | 178793 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 521 | 6 | 0 | 6 | 5.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL267849 | 208989 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||||
14208225 | 67412 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL1907855 | 67412 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
155535249 | 171437 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1808 | 68 | 16 | 23 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4471373 | 171437 | 0 | None | - | 0 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 1808 | 68 | 16 | 23 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9601664 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9601664 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9601664 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9601664 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9601664 | ||||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950626d | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950626d | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950626d | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950626d | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm950626d | ||||
15667014 | 106774 | 0 | None | - | 0 | Guinea pig | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL316944 | 106774 | 0 | None | - | 0 | Guinea pig | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
132916 | 3112 | 11 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 10.1016/S0960-894X(96)00609-9 | ||
874 | 3112 | 11 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL300072 | 3112 | 11 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 438 | 3 | 2 | 3 | 3.8 | O=C(c1cc2c([nH]1)cccc2)N[C@H]1N=C(c2ccccc2F)c2c3N(C1=O)CCc3ccc2 | 10.1016/S0960-894X(96)00609-9 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(96)00160-6 | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm991078x | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm991078x | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000959x | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000959x | ||
44562313 | 171891 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
CHEMBL448118 | 171891 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 624 | 9 | 1 | 8 | 4.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)C[C@H]3CNS(C)(=O)=O)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.07.083 | ||
14208303 | 202985 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL73946 | 202985 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208303 | 202985 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73946 | 202985 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
15666988 | 106775 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL316949 | 106775 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
15666988 | 106775 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL316949 | 106775 | 0 | None | - | 0 | Guinea pig | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
3476 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00047a021 | ||
59751 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00047a021 | ||
878 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00047a021 | ||
CHEMBL39263 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00047a021 | ||
14208294 | 202534 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL70984 | 202534 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
14208296 | 202923 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(I)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73483 | 202923 | 1 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(I)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
155532425 | 171182 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4467338 | 171182 | 0 | None | - | 0 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 1822 | 71 | 18 | 23 | 2.5 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL1172428 | 206844 | 0 | None | - | 3 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00548-4 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00548-4 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00548-4 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00548-4 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(98)00548-4 | ||||
3476 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00120a002 | ||
59751 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00120a002 | ||
878 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00120a002 | ||
CHEMBL39263 | 1373 | 8 | None | - | 3 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00120a002 | ||
14208297 | 67404 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(I)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907848 | 67404 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(I)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208295 | 67407 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907850 | 67407 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
14208268 | 202779 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 418 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL72428 | 202779 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 418 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
13822922 | 188492 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 436 | 3 | 2 | 5 | 4.2 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)c1cc2ccccc2[nH]1 | 10.1021/jm00396a028 | ||
CHEMBL50986 | 188492 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 436 | 3 | 2 | 5 | 4.2 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)c1cc2ccccc2[nH]1 | 10.1021/jm00396a028 | ||
11757476 | 2033 | 1 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 10.1021/jm991078x | ||
876 | 2033 | 1 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 10.1021/jm991078x | ||
CHEMBL2112828 | 2033 | 1 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 558 | 7 | 4 | 4 | 3.7 | O=C(NC(C)(C)C)N[C@H](C(=O)N[C@@H]1CCCN2[C@H]1CC(=O)N(C2=O)Cc1ccccc1)Cc1c[nH]c2c1cccc2 | 10.1021/jm991078x | ||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
155526914 | 170636 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 1837 | 72 | 19 | 24 | 0.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4459331 | 170636 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 1837 | 72 | 19 | 24 | 0.8 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
11017163 | 79135 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccccc1N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
CHEMBL2114081 | 79135 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccccc1N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
15667011 | 96209 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL263742 | 96209 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
15667011 | 96209 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL263742 | 96209 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 990 | 29 | 9 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
196641 | 202693 | 7 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL71950 | 202693 | 7 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00198-0 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00198-0 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00198-0 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00198-0 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00198-0 | ||||
44469677 | 15004 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 336 | 4 | 1 | 4 | 5.4 | C/C(=N\OC(=O)Nc1ccccc1)c1cccc(-c2cccs2)c1 | 10.1016/j.bmcl.2010.06.050 | ||
CHEMBL1210154 | 15004 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 336 | 4 | 1 | 4 | 5.4 | C/C(=N\OC(=O)Nc1ccccc1)c1cccc(-c2cccs2)c1 | 10.1016/j.bmcl.2010.06.050 | ||
196641 | 202693 | 7 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL71950 | 202693 | 7 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
16755782 | 178771 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473663 | 178771 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44329487 | 108027 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3cccc(F)c3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL319986 | 108027 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3cccc(F)c3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
155564421 | 174696 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 1770 | 69 | 16 | 21 | 3.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4572516 | 174696 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 1770 | 69 | 16 | 21 | 3.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm991078x | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm991078x | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm991078x | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm991078x | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm991078x | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0498755 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0498755 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0498755 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0498755 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0498755 | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010898i | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010898i | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010898i | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010898i | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010898i | ||||
444998 | 207574 | 26 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm010813d | ||||
CHEMBL216166 | 207574 | 26 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm010813d | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00107-8 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00107-8 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00107-8 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00107-8 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00107-8 | ||||
10033396 | 108102 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 824 | 20 | 8 | 7 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL320405 | 108102 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 824 | 20 | 8 | 7 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
44329323 | 106859 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 574 | 7 | 3 | 3 | 6.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)Nc3ccccc3C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL317615 | 106859 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 574 | 7 | 3 | 3 | 6.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)Nc3ccccc3C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
44329331 | 107579 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(C)c3)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c3ccccc3)C2)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL319504 | 107579 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(C)c3)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c3ccccc3)C2)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
44329363 | 108217 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 594 | 7 | 3 | 3 | 7.2 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)Nc3ccccc3Cl)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL320821 | 108217 | 0 | None | - | 0 | Guinea pig | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 594 | 7 | 3 | 3 | 7.2 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)Nc3ccccc3Cl)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
11027990 | 67192 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL189634 | 67192 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
44269000 | 32697 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 671 | 14 | 6 | 5 | 6.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/s0960-894x(00)00198-0 | ||
CHEMBL14153 | 32697 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 671 | 14 | 6 | 5 | 6.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/s0960-894x(00)00198-0 | ||
44269000 | 32697 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 671 | 14 | 6 | 5 | 6.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/s0960-894x(01)00630-8 | ||
CHEMBL14153 | 32697 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 671 | 14 | 6 | 5 | 6.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/s0960-894x(01)00630-8 | ||
155533399 | 171279 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1838 | 72 | 19 | 24 | 1.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4468861 | 171279 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 1838 | 72 | 19 | 24 | 1.4 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00062-0 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00062-0 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00062-0 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00062-0 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00062-0 | ||||
14208311 | 202958 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73699 | 202958 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
14208227 | 101794 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 3 | 1 | 4 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL303227 | 101794 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 3 | 1 | 4 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208312 | 77469 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092865 | 77469 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
10373344 | 166081 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 844 | 21 | 8 | 7 | 3.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL428103 | 166081 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 844 | 21 | 8 | 7 | 3.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
10341724 | 78106 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL2111922 | 78106 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
24861174 | 174035 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL455742 | 174035 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 546 | 6 | 1 | 6 | 5.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578424 | 182344 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479256 | 182344 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44329286 | 106721 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3cccc(C)c3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL316619 | 106721 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3cccc(C)c3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960249k | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960249k | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960249k | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960249k | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960249k | ||||
4627 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960205b | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960205b | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960205b | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960205b | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm960205b | ||||
4627 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970265x | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970265x | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970265x | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970265x | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970265x | ||||
11082524 | 114954 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 591 | 7 | 3 | 5 | 5.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=S)N(Cc3ccccc3)C(=S)C[C@@H]12 | 10.1021/jm010898i | ||
CHEMBL3350853 | 114954 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 591 | 7 | 3 | 5 | 5.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=S)N(Cc3ccccc3)C(=S)C[C@@H]12 | 10.1021/jm010898i | ||
14208227 | 101794 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 3 | 1 | 4 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL303227 | 101794 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 440 | 3 | 1 | 4 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL411202 | 211126 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
54580295 | 61584 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774032 | 61584 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2F)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
14208232 | 202438 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 452 | 5 | 3 | 4 | 3.2 | O=C(O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL70456 | 202438 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 452 | 5 | 3 | 4 | 3.2 | O=C(O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14208231 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL71079 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
10093957 | 202928 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL73522 | 202928 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10350551 | 107969 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 838 | 21 | 8 | 7 | 3.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL319913 | 107969 | 0 | None | - | 0 | Guinea pig | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 838 | 21 | 8 | 7 | 3.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
14208231 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL71079 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
14208231 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL71079 | 202544 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 422 | 3 | 1 | 4 | 3.7 | CN1C(=O)C(NC(=O)c2cc3ccccc3n2C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
10093957 | 202928 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73522 | 202928 | 1 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
14208228 | 102633 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 470 | 5 | 3 | 4 | 3.3 | O=C(O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL307661 | 102633 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 470 | 5 | 3 | 4 | 3.3 | O=C(O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1172429 | 206845 | 0 | None | 26 | 4 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
5311188 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
CHEMBL113718 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
5311188 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL113718 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44396619 | 165692 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 516 | 7 | 2 | 5 | 4.4 | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
CHEMBL426792 | 165692 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 516 | 7 | 2 | 5 | 4.4 | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
5311188 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010898i | ||
CHEMBL113718 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010898i | ||
5311188 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL113718 | 9712 | 2 | None | -1 | 2 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL107694 | 206748 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
44329330 | 106703 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3cccc(C)c3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL316504 | 106703 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3cccc(C)c3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
10076650 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm050689o | ||
CHEMBL13577 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm050689o | ||
10010723 | 4844 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 836 | 20 | 8 | 7 | 3.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)(F)F)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL104598 | 4844 | 0 | None | - | 0 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 836 | 20 | 8 | 7 | 3.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)(F)F)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00086a017 | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00086a017 | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00086a017 | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00086a017 | ||
10076650 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1016/s0960-894x(01)00630-8 | ||
CHEMBL13577 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1016/s0960-894x(01)00630-8 | ||
10076650 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
CHEMBL13577 | 26027 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
44329352 | 110949 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(F)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL327496 | 110949 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(F)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
44578647 | 178748 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2c(F)cccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL473457 | 178748 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 538 | 6 | 0 | 5 | 6.3 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2c(F)cccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24785178 | 180957 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476530 | 180957 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44578423 | 189067 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515161 | 189067 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24785431 | 189218 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL516355 | 189218 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2F)c1 | 10.1016/j.bmcl.2008.06.057 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44365788 | 121179 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 643 | 7 | 1 | 7 | 5.5 | COC(=O)n1c(C(=O)NC2C(=O)N(CC(=O)N(c3ccccc3)C(C)C)c3ccccc3N(c3ccccc3)C2=O)cc2ccccc21 | 10.1021/jm9601664 | ||
CHEMBL358778 | 121179 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 643 | 7 | 1 | 7 | 5.5 | COC(=O)n1c(C(=O)NC2C(=O)N(CC(=O)N(c3ccccc3)C(C)C)c3ccccc3N(c3ccccc3)C2=O)cc2ccccc21 | 10.1021/jm9601664 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1172252 | 206842 | 0 | None | -12 | 4 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
10046672 | 115582 | 1 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN1C(=O)C(NC(=O)Nc2cccc(F)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL335666 | 115582 | 1 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN1C(=O)C(NC(=O)Nc2cccc(F)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10364786 | 104392 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)NC2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL311061 | 104392 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)NC2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
44329383 | 107805 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 526 | 6 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@H]2C[C@H](c3ccccc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL319749 | 107805 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 526 | 6 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@H]2C[C@H](c3ccccc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10364786 | 104392 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)NC2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL311061 | 104392 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)NC2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
10627173 | 204816 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 8 | 1 | 4 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL88602 | 204816 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 8 | 1 | 4 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
44346576 | 10669 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 399 | 4 | 2 | 3 | 3.8 | O=C(/C=C\c1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL117158 | 10669 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 399 | 4 | 2 | 3 | 3.8 | O=C(/C=C\c1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
14208272 | 67397 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL1907841 | 67397 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
10627173 | 204816 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 8 | 1 | 4 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
CHEMBL88602 | 204816 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 586 | 8 | 1 | 4 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
14208230 | 102734 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 446 | 3 | 3 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL308414 | 102734 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 446 | 3 | 3 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 | 10.1021/jm00047a021 | ||
14208274 | 168726 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)C(NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL441445 | 168726 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)C(NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
15689736 | 106118 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC/N=C(\S)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142702 | 106118 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC/N=C(\S)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
11801335 | 119030 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 579 | 7 | 2 | 4 | 5.5 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(F)cc1 | 10.1021/jm950626d | ||
CHEMBL345786 | 119030 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 579 | 7 | 2 | 4 | 5.5 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(F)cc1 | 10.1021/jm950626d | ||
44306868 | 101613 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 836 | 18 | 9 | 7 | 3.7 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL302150 | 101613 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 836 | 18 | 9 | 7 | 3.7 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
44306888 | 101860 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL303635 | 101860 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
13953709 | 161788 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 409 | 4 | 1 | 6 | 4.0 | O=C(NC1N=C(c2ccccc2)c2ccccc2-n2cnnc21)OCc1ccccc1 | 10.1021/jm00396a028 | ||
CHEMBL416483 | 161788 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 409 | 4 | 1 | 6 | 4.0 | O=C(NC1N=C(c2ccccc2)c2ccccc2-n2cnnc21)OCc1ccccc1 | 10.1021/jm00396a028 | ||
14208274 | 168726 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)C(NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL441445 | 168726 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)C(NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
9988264 | 109235 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 888 | 22 | 9 | 8 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL322955 | 109235 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 888 | 22 | 9 | 8 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
10886229 | 78183 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1cccc(N2C(=O)C[C@@H]3[C@@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
CHEMBL2112234 | 78183 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1cccc(N2C(=O)C[C@@H]3[C@@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
44382057 | 119829 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)N[C@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL352939 | 119829 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)N[C@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
44301015 | 197383 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 609 | 7 | 5 | 7 | 3.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)Nc3nn[nH]n3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL58658 | 197383 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 609 | 7 | 5 | 7 | 3.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)Nc3nn[nH]n3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
10001488 | 164374 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 408 | 4 | 3 | 3 | 3.6 | O=C(Cc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL422411 | 164374 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 408 | 4 | 3 | 3 | 3.6 | O=C(Cc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL2112688 | 207504 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)[C@H](C)c1c[nH]c2ccccc12 | 10.1021/jm960078j | ||||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10001488 | 164374 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 408 | 4 | 3 | 3 | 3.6 | O=C(Cc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL422411 | 164374 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 408 | 4 | 3 | 3 | 3.6 | O=C(Cc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
14208202 | 202936 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 443 | 4 | 2 | 4 | 4.5 | O=C(Cc1cccc2sccc12)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL73563 | 202936 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 443 | 4 | 2 | 4 | 4.5 | O=C(Cc1cccc2sccc12)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
44362701 | 120621 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL357576 | 120621 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
44370446 | 119096 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 467 | 15 | 2 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCC)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL346361 | 119096 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 467 | 15 | 2 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCC)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
20152922 | 118470 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 440 | 5 | 2 | 3 | 4.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)Cc1c[nH]c2ccccc12 | 10.1021/jm00163a069 | ||
CHEMBL342415 | 118470 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 440 | 5 | 2 | 3 | 4.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)Cc1c[nH]c2ccccc12 | 10.1021/jm00163a069 | ||
10414170 | 170051 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
CHEMBL445095 | 170051 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
15200522 | 119962 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 422 | 4 | 2 | 3 | 3.7 | CN1C(=O)C(NC(=O)Cc2c[nH]c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL354126 | 119962 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 422 | 4 | 2 | 3 | 3.7 | CN1C(=O)C(NC(=O)Cc2c[nH]c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL37983 | 210519 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | None | None | None | CS[C@H]1CCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00001a019 | ||||
656755 | 67368 | 28 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 397 | 3 | 1 | 2 | 4.7 | CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907717 | 67368 | 28 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 397 | 3 | 1 | 2 | 4.7 | CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
15167824 | 67377 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 379 | 3 | 1 | 2 | 4.6 | CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907731 | 67377 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 379 | 3 | 1 | 2 | 4.6 | CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
20190196 | 31572 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 388 | 4 | 1 | 4 | 3.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1cccnc1 | 10.1021/jm00163a069 | ||
CHEMBL140620 | 31572 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 388 | 4 | 1 | 4 | 3.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1cccnc1 | 10.1021/jm00163a069 | ||
15167799 | 118682 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 379 | 4 | 2 | 4 | 3.9 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)c1ccsc1 | 10.1021/jm00163a069 | ||
CHEMBL343158 | 118682 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 379 | 4 | 2 | 4 | 3.9 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)c1ccsc1 | 10.1021/jm00163a069 | ||
44381820 | 120112 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 689 | 18 | 7 | 8 | 2.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](C#N)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL354631 | 120112 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 689 | 18 | 7 | 8 | 2.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](C#N)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
44381821 | 120113 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 689 | 18 | 7 | 8 | 2.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@H](C#N)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL354632 | 120113 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 689 | 18 | 7 | 8 | 2.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@H](C#N)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
44348835 | 16642 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 938 | 25 | 11 | 11 | 0.2 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL124719 | 16642 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 938 | 25 | 11 | 11 | 0.2 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
14208262 | 202814 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 431 | 4 | 2 | 3 | 4.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm00047a021 | ||
CHEMBL72670 | 202814 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 431 | 4 | 2 | 3 | 4.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm00047a021 | ||
7216755 | 59228 | 7 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 265 | 1 | 1 | 3 | 1.8 | CN1C(=O)[C@@H](N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL171651 | 59228 | 7 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 265 | 1 | 1 | 3 | 1.8 | CN1C(=O)[C@@H](N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
44311988 | 102557 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 412 | 5 | 2 | 4 | 2.5 | CN1C(=O)[C@H](NC(=O)[C@H](N)Cc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL307034 | 102557 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 412 | 5 | 2 | 4 | 2.5 | CN1C(=O)[C@H](NC(=O)[C@H](N)Cc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14208206 | 162917 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 403 | 4 | 3 | 4 | 2.8 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1NC(=O)C(O)c1ccccc1 | 10.1021/jm00120a002 | ||
CHEMBL419997 | 162917 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 403 | 4 | 3 | 4 | 2.8 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1NC(=O)C(O)c1ccccc1 | 10.1021/jm00120a002 | ||
14208262 | 202814 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 431 | 4 | 2 | 3 | 4.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm00120a002 | ||
CHEMBL72670 | 202814 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 431 | 4 | 2 | 3 | 4.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(-c2ccccc2)cc1 | 10.1021/jm00120a002 | ||
2794055 | 67366 | 3 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 360 | 3 | 1 | 2 | 4.7 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1Cc1ccccc1 | 10.1021/jm00390a019 | ||
CHEMBL1907712 | 67366 | 3 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 360 | 3 | 1 | 2 | 4.7 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1Cc1ccccc1 | 10.1021/jm00390a019 | ||
15167780 | 67371 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 415 | 3 | 2 | 3 | 4.6 | O=C1Nc2ccccc2C1C[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O | 10.1021/jm00390a019 | ||
CHEMBL1907723 | 67371 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 415 | 3 | 2 | 3 | 4.6 | O=C1Nc2ccccc2C1C[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O | 10.1021/jm00390a019 | ||
15614736 | 166754 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 410 | 3 | 1 | 2 | 5.9 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1Cc1cccc2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL429391 | 166754 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 410 | 3 | 1 | 2 | 5.9 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1Cc1cccc2ccccc12 | 10.1021/jm00390a019 | ||
44359880 | 32113 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 428 | 7 | 2 | 5 | 2.4 | CC(=O)NCSCC(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
CHEMBL141048 | 32113 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 428 | 7 | 2 | 5 | 2.4 | CC(=O)NCSCC(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
44359841 | 116129 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 6.5 | CCN(CC)c1ccc(NCC2CN=C(c3ccccc3F)c3ccccc3N2C)cc1C(F)(F)F | 10.1021/jm00163a069 | ||
CHEMBL336881 | 116129 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 498 | 7 | 1 | 4 | 6.5 | CCN(CC)c1ccc(NCC2CN=C(c3ccccc3F)c3ccccc3N2C)cc1C(F)(F)F | 10.1021/jm00163a069 | ||
7216755 | 59228 | 7 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 265 | 1 | 1 | 3 | 1.8 | CN1C(=O)[C@@H](N)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL171651 | 59228 | 7 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 265 | 1 | 1 | 3 | 1.8 | CN1C(=O)[C@@H](N)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
71450869 | 83964 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 650 | 12 | 5 | 6 | 4.3 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCS(=O)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112338 | 83964 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 650 | 12 | 5 | 6 | 4.3 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCS(=O)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2219559 | 83964 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 650 | 12 | 5 | 6 | 4.3 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCS(=O)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
10325770 | 130173 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 573 | 8 | 4 | 5 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)[C@@](Cc3ccccc3)(C(N)=O)C[C@H]12 | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL368380 | 130173 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 573 | 8 | 4 | 5 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)[C@@](Cc3ccccc3)(C(N)=O)C[C@H]12 | 10.1016/0960-894X(96)00160-6 | ||
44349203 | 116553 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCCC2)C1 | 10.1021/jm00079a003 | ||
CHEMBL339134 | 116553 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCCC2)C1 | 10.1021/jm00079a003 | ||
45482109 | 196373 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL574062 | 196373 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44408411 | 160763 | 0 | None | -2089 | 4 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 1242 | 31 | 11 | 15 | 4.4 | CCCC[C@@H](C(=O)N[C@@H](Cc1cn(C(C)=O)c2ccccc12)C(=O)O)N(C(=O)Nc1ccccc1Cl)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)N(C)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
CHEMBL412331 | 160763 | 0 | None | -2089 | 4 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 1242 | 31 | 11 | 15 | 4.4 | CCCC[C@@H](C(=O)N[C@@H](Cc1cn(C(C)=O)c2ccccc12)C(=O)O)N(C(=O)Nc1ccccc1Cl)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)N(C)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
44408484 | 136983 | 0 | None | -19498 | 4 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 1033 | 30 | 13 | 12 | 1.4 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL375412 | 136983 | 0 | None | -19498 | 4 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 1033 | 30 | 13 | 12 | 1.4 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
44418924 | 156340 | 0 | None | -19952 | 4 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](N)Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL407198 | 156340 | 0 | None | -19952 | 4 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](N)Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL333299 | 209645 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a068 | ||||
10340882 | 25824 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3cccnc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL135498 | 25824 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3cccnc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
10256428 | 119183 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL347278 | 119183 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
108187 | 913 | 30 | None | - | 5 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00017a022 | ||
873 | 913 | 30 | None | - | 5 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL2062154 | 913 | 30 | None | - | 5 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL287735 | 913 | 30 | None | - | 5 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL205965 | 207425 | 0 | None | - | 3 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
44369590 | 119044 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 458 | 7 | 3 | 6 | 3.5 | Cc1cccc(NCNC2N=C(c3cc[nH]n3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL345880 | 119044 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 458 | 7 | 3 | 6 | 3.5 | Cc1cccc(NCNC2N=C(c3cc[nH]n3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
51353551 | 17950 | 10 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44353183 | 116276 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 555 | 8 | 3 | 4 | 5.2 | O=C(OC1C2CC3CC(C2)CC1C3)N1CCCC1(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
CHEMBL337692 | 116276 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 555 | 8 | 3 | 4 | 5.2 | O=C(OC1C2CC3CC(C2)CC1C3)N1CCCC1(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
71456173 | 78075 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CC[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL2111826 | 78075 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CC[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
10342469 | 196923 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL578650 | 196923 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44283496 | 99711 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 527 | 9 | 2 | 3 | 6.1 | CC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL288037 | 99711 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 527 | 9 | 2 | 3 | 6.1 | CC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10668688 | 205799 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 400 | 4 | 4 | 6 | 3.4 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9465 | 205799 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 400 | 4 | 4 | 6 | 3.4 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N)c2)c1 | 10.1021/jm970373j | ||
53465782 | 69066 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 455 | 9 | 4 | 3 | 4.6 | O=C(Nc1ccccc1C(=O)NC(CCCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933101 | 69066 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 455 | 9 | 4 | 3 | 4.6 | O=C(Nc1ccccc1C(=O)NC(CCCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10793168 | 167330 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 570 | 7 | 1 | 3 | 6.9 | CC(C)N(C(=O)CN1C(=O)C(C)(Cc2c[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
CHEMBL431212 | 167330 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 570 | 7 | 1 | 3 | 6.9 | CC(C)N(C(=O)CN1C(=O)C(C)(Cc2c[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
9960964 | 85566 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 12 | 5 | 7 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCc1nnn[nH]1)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304152 | 85566 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 12 | 5 | 7 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCc1nnn[nH]1)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
10325426 | 107115 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL318963 | 107115 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1016/S0960-894X(01)80769-1 | ||
10165354 | 21946 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(CO)Cc1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
CHEMBL132233 | 21946 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(CO)Cc1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
44283132 | 120288 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 485 | 9 | 3 | 3 | 5.9 | CC(CNCCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL35555 | 120288 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 485 | 9 | 3 | 3 | 5.9 | CC(CNCCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10624013 | 33319 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 464 | 6 | 3 | 4 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCC1 | 10.1021/jm970065l | ||
CHEMBL142063 | 33319 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 464 | 6 | 3 | 4 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCC1 | 10.1021/jm970065l | ||
14208240 | 101875 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 4 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00047a021 | ||
CHEMBL303724 | 101875 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 4 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00047a021 | ||
14208213 | 202902 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 362 | 3 | 3 | 3 | 2.7 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL73272 | 202902 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 362 | 3 | 3 | 3 | 2.7 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc[nH]1 | 10.1021/jm00047a021 | ||
9896825 | 102504 | 0 | None | - | 1 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 742 | 14 | 6 | 10 | 2.9 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30656 | 102504 | 0 | None | - | 1 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 742 | 14 | 6 | 10 | 2.9 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
14208314 | 102450 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2I)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL306166 | 102450 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2I)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
14208199 | 102598 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1c[nH]c2ccccc12 | 10.1021/jm00047a021 | ||
CHEMBL307370 | 102598 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1c[nH]c2ccccc12 | 10.1021/jm00047a021 | ||
CHEMBL218327 | 207649 | 0 | None | -2630 | 4 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
14208272 | 67397 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907841 | 67397 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208208 | 168912 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 399 | 4 | 2 | 3 | 3.8 | O=C(/C=C/c1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL443009 | 168912 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 399 | 4 | 2 | 3 | 3.8 | O=C(/C=C/c1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
10260206 | 166913 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 918 | 21 | 8 | 8 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL429932 | 166913 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 918 | 21 | 8 | 8 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL415706 | 211451 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
44341426 | 109850 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccc(O)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL324022 | 109850 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccc(O)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
9934162 | 27523 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3c[nH]cn3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL137043 | 27523 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3c[nH]cn3)C2=O)c1 | 10.1021/jm00078a018 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10432393 | 99882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 422 | 3 | 3 | 3 | 4.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00121a004 | ||
CHEMBL289533 | 99882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 422 | 3 | 3 | 3 | 4.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00121a004 | ||
14208242 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL40668 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
14208240 | 101875 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 4 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00120a002 | ||
CHEMBL303724 | 101875 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 4 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00120a002 | ||
14208242 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL40668 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208213 | 202902 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 362 | 3 | 3 | 3 | 2.7 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL73272 | 202902 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 362 | 3 | 3 | 3 | 2.7 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc[nH]1 | 10.1021/jm00120a002 | ||
5279169 | 25994 | 1 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 404 | 3 | 3 | 3 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00078a018 | ||
CHEMBL135715 | 25994 | 1 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 404 | 3 | 3 | 3 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00078a018 | ||
10070678 | 120242 | 1 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL355092 | 120242 | 1 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14208242 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL40668 | 155882 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 493 | 6 | 1 | 5 | 4.0 | CCOC(=O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00078a018 | ||
90663976 | 106316 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccccc1O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144538 | 106316 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccccc1O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14991577 | 162693 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 870 | 20 | 9 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2cc(Cl)ccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL418500 | 162693 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 870 | 20 | 9 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2cc(Cl)ccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44381960 | 119773 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 474 | 3 | 3 | 4 | 4.6 | CN1C(=O)[C@@H](NC(=O)Nc2cc3c4ccccc4nc-3c[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL352573 | 119773 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 474 | 3 | 3 | 4 | 4.6 | CN1C(=O)[C@@H](NC(=O)Nc2cc3c4ccccc4nc-3c[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
44301037 | 100390 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 633 | 8 | 4 | 6 | 4.0 | CCS(=O)(=O)NC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL293490 | 100390 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 633 | 8 | 4 | 6 | 4.0 | CCS(=O)(=O)NC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
10319892 | 58782 | 2 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL169661 | 58782 | 2 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
14208199 | 102598 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
CHEMBL307370 | 102598 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
10182876 | 202422 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 457 | 7 | 1 | 3 | 5.1 | CCCCCc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL70361 | 202422 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 457 | 7 | 1 | 3 | 5.1 | CCCCCc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
14208280 | 67346 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 335 | 3 | 1 | 3 | 2.6 | CC(C)C(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00120a002 | ||
CHEMBL1907665 | 67346 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 335 | 3 | 1 | 3 | 2.6 | CC(C)C(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00120a002 | ||
14208315 | 67395 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2I)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907839 | 67395 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2I)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14802528 | 117961 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 642 | 14 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CCCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL341281 | 117961 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 642 | 14 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CCCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
15104622 | 9938 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1cccc(C)c1 | 10.1021/jm00116a002 | ||
CHEMBL115093 | 9938 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1cccc(C)c1 | 10.1021/jm00116a002 | ||
14720389 | 164531 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL422701 | 164531 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
10075297 | 115007 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 518 | 6 | 3 | 5 | 4.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)Nc3ccncc3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL335239 | 115007 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 518 | 6 | 3 | 5 | 4.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)Nc3ccncc3)C2=O)c1 | 10.1021/jm00078a018 | ||
14991564 | 106320 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 827 | 21 | 9 | 9 | 2.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144541 | 106320 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 827 | 21 | 9 | 9 | 2.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44334338 | 108426 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 547 | 9 | 2 | 5 | 4.2 | Cc1cccc(NC(=O)N[C@H](CS(=O)(=O)Cc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL321107 | 108426 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 547 | 9 | 2 | 5 | 4.2 | Cc1cccc(NC(=O)N[C@H](CS(=O)(=O)Cc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
10319892 | 58782 | 2 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL169661 | 58782 | 2 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
14519983 | 119471 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL349857 | 119471 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00124a003 | ||
14519979 | 9439 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00124a003 | ||
CHEMBL112215 | 9439 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00124a003 | ||
44349070 | 163939 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL421438 | 163939 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL103485 | 206715 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
14208251 | 77474 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092870 | 77474 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
15167804 | 67369 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 6 | 2 | 3 | 4.6 | O=C(O)CCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907719 | 67369 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 455 | 6 | 2 | 3 | 4.6 | O=C(O)CCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
45482485 | 196334 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 486 | 8 | 3 | 6 | 3.8 | Cn1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)cc2cc([N+](=O)[O-])ccc21 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL573793 | 196334 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 486 | 8 | 3 | 6 | 3.8 | Cn1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)cc2cc([N+](=O)[O-])ccc21 | 10.1016/j.bmc.2009.05.067 | ||
21842317 | 121166 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL358646 | 121166 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
21842317 | 121166 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL358646 | 121166 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
10322988 | 10053 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL115772 | 10053 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 482 | 5 | 2 | 4 | 4.9 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
44349434 | 116514 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 396 | 11 | 3 | 3 | 3.6 | CCC(C)(CC)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL338929 | 116514 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 396 | 11 | 3 | 3 | 3.6 | CCC(C)(CC)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
5311201 | 205663 | 30 | None | - | 6 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
5311201 | 205663 | 30 | None | - | 6 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL9387 | 205663 | 30 | None | - | 6 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL9387 | 205663 | 30 | None | - | 6 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
10722103 | 110986 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 588 | 8 | 1 | 6 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ncccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL327656 | 110986 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 588 | 8 | 1 | 6 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ncccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
73349872 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL2367718 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL2367719 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/0960-894X(96)00160-6 | ||
11442153 | 196521 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 444 | 7 | 3 | 4 | 4.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2s1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL575161 | 196521 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 444 | 7 | 3 | 4 | 4.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2s1 | 10.1016/j.bmc.2009.05.067 | ||
10789434 | 204910 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 444 | 6 | 3 | 8 | 3.1 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccnc2)c1 | 10.1021/jm970373j | ||
CHEMBL8921 | 204910 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 444 | 6 | 3 | 8 | 3.1 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccnc2)c1 | 10.1021/jm970373j | ||
73349872 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1021/jm0498755 | ||
CHEMBL2367718 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1021/jm0498755 | ||
CHEMBL2367719 | 88771 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1021/jm0498755 | ||
10839478 | 110168 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 512 | 6 | 2 | 6 | 4.1 | CN(C)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL325863 | 110168 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 512 | 6 | 2 | 6 | 4.1 | CN(C)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
15104595 | 9997 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL115456 | 9997 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
138106885 | 166358 | 71 | None | -1 | 4 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
36314 | 166358 | 71 | None | -1 | 4 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
CHEMBL428647 | 166358 | 71 | None | -1 | 4 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
44592082 | 178564 | 0 | None | - | 0 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL472079 | 178564 | 0 | None | - | 0 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
10413579 | 116582 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1ccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)cc1 | 10.1021/jm00048a015 | ||
CHEMBL339260 | 116582 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1ccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)cc1 | 10.1021/jm00048a015 | ||
44283152 | 99392 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 501 | 10 | 4 | 4 | 4.8 | O=C(NC(CNC(CO)Cc1ccccc1)Cc1c[nH]c2ccccc12)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL285762 | 99392 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 501 | 10 | 4 | 4 | 4.8 | O=C(NC(CNC(CO)Cc1ccccc1)Cc1c[nH]c2ccccc12)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
14208313 | 67398 | 0 | None | - | 0 | Rat | 3.9 | pIC50 | = | 3.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907842 | 67398 | 0 | None | - | 0 | Rat | 3.9 | pIC50 | = | 3.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
44591978 | 183327 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 533 | 10 | 4 | 4 | 5.4 | O=C(Nc1ccccc1C(=O)NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL481265 | 183327 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 533 | 10 | 4 | 4 | 5.4 | O=C(Nc1ccccc1C(=O)NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
19766227 | 32984 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 469 | 6 | 3 | 4 | 3.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(N)Cc1c[nH]c2ccccc12 | 10.1021/jm00163a069 | ||
CHEMBL141786 | 32984 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 469 | 6 | 3 | 4 | 3.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(N)Cc1c[nH]c2ccccc12 | 10.1021/jm00163a069 | ||
132190 | 119831 | 16 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | O=C1NN(C(=O)Nc2ccc(Br)cc2)C(c2ccccc2)C1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL352949 | 119831 | 16 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | O=C1NN(C(=O)Nc2ccc(Br)cc2)C(c2ccccc2)C1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
10373378 | 49396 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 854 | 20 | 8 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C | 10.1021/jm00031a013 | ||
CHEMBL156642 | 49396 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 854 | 20 | 8 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C | 10.1021/jm00031a013 | ||
10530757 | 118058 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 553 | 10 | 3 | 7 | 3.6 | COC(=O)CC(CC(=O)OC)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
CHEMBL341560 | 118058 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 553 | 10 | 3 | 7 | 3.6 | COC(=O)CC(CC(=O)OC)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
44287092 | 99995 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 824 | 21 | 7 | 7 | 5.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL290702 | 99995 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 824 | 21 | 7 | 7 | 5.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44368382 | 45084 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL152682 | 45084 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44286961 | 161518 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 824 | 22 | 8 | 7 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL416064 | 161518 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 824 | 22 | 8 | 7 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
10478431 | 9806 | 7 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL114325 | 9806 | 7 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00124a003 | ||
127050962 | 140215 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 283 | 3 | 1 | 2 | 2.6 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccc(F)cc1 | 10.1039/C6MD00052E | ||
CHEMBL3818164 | 140215 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 283 | 3 | 1 | 2 | 2.6 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccc(F)cc1 | 10.1039/C6MD00052E | ||
10478431 | 9806 | 7 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL114325 | 9806 | 7 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00116a002 | ||
10919004 | 78023 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 7 | 3 | 7 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL2111547 | 78023 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 590 | 7 | 3 | 7 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10032955 | 167472 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL432256 | 167472 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
52949124 | 863 | 2 | None | - | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
9055 | 863 | 2 | None | - | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269258 | 863 | 2 | None | - | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
DB12694 | 863 | 2 | None | - | 2 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
13953715 | 193010 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 428 | 3 | 2 | 5 | 4.6 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2-n2cnnc21 | 10.1021/jm00396a028 | ||
CHEMBL53234 | 193010 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 428 | 3 | 2 | 5 | 4.6 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2-n2cnnc21 | 10.1021/jm00396a028 | ||
127050298 | 140309 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 265 | 1 | 1 | 2 | 2.6 | CC(C)(C)N1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3819315 | 140309 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 265 | 1 | 1 | 2 | 2.6 | CC(C)(C)N1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
14208233 | 202812 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 490 | 3 | 3 | 3 | 4.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Br)ccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL72667 | 202812 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 490 | 3 | 3 | 3 | 4.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Br)ccc2[nH]1 | 10.1021/jm00120a002 | ||
44341429 | 109963 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00116a002 | ||
CHEMBL324652 | 109963 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00116a002 | ||
14888719 | 76883 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1041 | 29 | 11 | 14 | -0.1 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(-c2nn[nH]n2)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079547 | 76883 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1041 | 29 | 11 | 14 | -0.1 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(-c2nn[nH]n2)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
44370694 | 47746 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL155017 | 47746 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
10459108 | 28197 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 513 | 8 | 2 | 5 | 3.9 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137516 | 28197 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 513 | 8 | 2 | 5 | 3.9 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
9977368 | 115748 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2cccnc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL335865 | 115748 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2cccnc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
90663992 | 106338 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 866 | 22 | 8 | 9 | 3.3 | CN(C)c1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
CHEMBL3144561 | 106338 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 866 | 22 | 8 | 9 | 3.3 | CN(C)c1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
14991536 | 106344 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144567 | 106344 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44279861 | 102709 | 0 | None | - | 1 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 726 | 14 | 6 | 9 | 3.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30821 | 102709 | 0 | None | - | 1 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 726 | 14 | 6 | 9 | 3.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
23844129 | 113000 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 497 | 6 | 3 | 5 | 4.7 | CNc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL332024 | 113000 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 497 | 6 | 3 | 5 | 4.7 | CNc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
14208233 | 202812 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 490 | 3 | 3 | 3 | 4.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Br)ccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL72667 | 202812 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 490 | 3 | 3 | 3 | 4.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Br)ccc2[nH]1 | 10.1021/jm00047a021 | ||
10721792 | 167223 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 571 | 7 | 1 | 4 | 6.3 | CC(C)N(C(=O)CN1C(=O)C(C)(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
CHEMBL430451 | 167223 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 571 | 7 | 1 | 4 | 6.3 | CC(C)N(C(=O)CN1C(=O)C(C)(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
10392653 | 118536 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 5 | 2 | 5 | 3.4 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3ccc(Cl)cc3)N=C(c3ccccc3)c3ccccc32)CC1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL342640 | 118536 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 5 | 2 | 5 | 3.4 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3ccc(Cl)cc3)N=C(c3ccccc3)c3ccccc32)CC1 | 10.1016/S0960-894X(00)80683-6 | ||
10456021 | 205775 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | COC(=O)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9449 | 205775 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | COC(=O)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm970373j | ||
21842327 | 45783 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 6 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)C)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL153308 | 45783 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 468 | 6 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)C)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
11316391 | 196201 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 431 | 7 | 4 | 3 | 3.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2c([nH]1)CCCC2 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL572650 | 196201 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 431 | 7 | 4 | 3 | 3.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2c([nH]1)CCCC2 | 10.1016/j.bmc.2009.05.067 | ||
44382698 | 59160 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 742 | 15 | 5 | 7 | 5.3 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccc(OS(=O)(=O)O)cc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL171375 | 59160 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 742 | 15 | 5 | 7 | 5.3 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccc(OS(=O)(=O)O)cc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
44370446 | 119096 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 15 | 2 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCC)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL346361 | 119096 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 15 | 2 | 4 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCC)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
10392653 | 118536 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 5 | 2 | 5 | 3.4 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3ccc(Cl)cc3)N=C(c3ccccc3)c3ccccc32)CC1 | 10.1021/jm00078a018 | ||
CHEMBL342640 | 118536 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 544 | 5 | 2 | 5 | 3.4 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3ccc(Cl)cc3)N=C(c3ccccc3)c3ccccc32)CC1 | 10.1021/jm00078a018 | ||
10070677 | 161175 | 13 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL41361 | 161175 | 13 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10456021 | 205775 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | COC(=O)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL9449 | 205775 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | COC(=O)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL338056 | 209858 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||||
15673180 | 85570 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 13 | 6 | 8 | 3.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)Nc1nn[nH]n1)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304157 | 85570 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 13 | 6 | 8 | 3.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)Nc1nn[nH]n1)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL3142686 | 209383 | 0 | None | - | 0 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
44272230 | 66740 | 0 | None | - | 0 | Mouse | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 442 | 6 | 3 | 3 | 2.9 | C[C@H](NC(=O)C1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80644-7 | ||
CHEMBL18727 | 66740 | 0 | None | - | 0 | Mouse | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 442 | 6 | 3 | 3 | 2.9 | C[C@H](NC(=O)C1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80644-7 | ||
14208310 | 67399 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 5.0 | CCCCCc1ccc(C(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL1907843 | 67399 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 5.0 | CCCCCc1ccc(C(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
10454826 | 98880 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00234-K | ||
CHEMBL282294 | 98880 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00234-K | ||
10838675 | 205484 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 487 | 8 | 3 | 8 | 4.1 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OCC)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9267 | 205484 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 487 | 8 | 3 | 8 | 4.1 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OCC)c2)c1 | 10.1021/jm970373j | ||
10279334 | 124537 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 513 | 8 | 2 | 3 | 5.7 | CN(CCc1ccccc1)C(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL36443 | 124537 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 513 | 8 | 2 | 3 | 5.7 | CN(CCc1ccccc1)C(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10253714 | 25290 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 4 | 2 | 3 | 5.3 | CN1C(=O)C(NC(=O)Nc2cccc(-c3ccccc3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135060 | 25290 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 4 | 2 | 3 | 5.3 | CN1C(=O)C(NC(=O)Nc2cccc(-c3ccccc3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
15177358 | 98614 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.6 | O=C(NC(Cc1c[nH]c2ccccc12)NC(=O)C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL280502 | 98614 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.6 | O=C(NC(Cc1c[nH]c2ccccc12)NC(=O)C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
71457981 | 78119 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 1147 | 14 | 6 | 10 | 9.0 | CC(C)(C)OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12.CC(C)(C)OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
CHEMBL2111993 | 78119 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 1147 | 14 | 6 | 10 | 9.0 | CC(C)(C)OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12.CC(C)(C)OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
10720403 | 118925 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 507 | 6 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H]1CCCCC[C@H]1O | 10.1021/jm970065l | ||
CHEMBL344882 | 118925 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 507 | 6 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H]1CCCCC[C@H]1O | 10.1021/jm970065l | ||
13605417 | 205834 | 3 | None | - | 1 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
44359338 | 168101 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CC2CCC1C2 | 10.1021/jm970065l | ||
CHEMBL436411 | 168101 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CC2CCC1C2 | 10.1021/jm970065l | ||
9960432 | 39187 | 6 | None | -12 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
CHEMBL147186 | 39187 | 6 | None | -12 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
CHEMBL1172246 | 206839 | 0 | None | 1 | 4 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | N=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc2ccccc2)C(N)=O)NC(=O)[C@H](Cc2cc3ccccc3[nH]2)NC1=O | 10.1016/j.bmcl.2010.05.078 | ||||
10762723 | 96582 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 386 | 4 | 3 | 6 | 3.2 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccnc2)c1 | 10.1021/jm970373j | ||
CHEMBL266819 | 96582 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 386 | 4 | 3 | 6 | 3.2 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccnc2)c1 | 10.1021/jm970373j | ||
44349324 | 16494 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.4 | O=C(O)CCC(NC(=O)c1cccc(C(F)(F)F)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL124261 | 16494 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.4 | O=C(O)CCC(NC(=O)c1cccc(C(F)(F)F)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44274261 | 98412 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 782 | 19 | 8 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL279005 | 98412 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 782 | 19 | 8 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44283514 | 170050 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 585 | 12 | 3 | 4 | 6.0 | CC(Cc1c[nH]c2ccccc12)(CN(CCc1ccccc1)C(=O)CCC(=O)O)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL445094 | 170050 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 585 | 12 | 3 | 4 | 6.0 | CC(Cc1c[nH]c2ccccc12)(CN(CCc1ccccc1)C(=O)CCC(=O)O)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
11442807 | 76936 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 9 | 4 | 4 | 3.2 | CC(=O)N/C(=C/c1ccccc1)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1021/jm051050n | ||
CHEMBL208171 | 76936 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 9 | 4 | 4 | 3.2 | CC(=O)N/C(=C/c1ccccc1)C(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1021/jm051050n | ||
45481637 | 196665 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 10 | 4 | 4 | 3.2 | O=C(CC(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)N/C=C/c1ccccc1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576347 | 196665 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 10 | 4 | 4 | 3.2 | O=C(CC(=O)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)N/C=C/c1ccccc1 | 10.1016/j.bmc.2009.05.067 | ||
51353551 | 17950 | 10 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL1269257 | 17950 | 10 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10817241 | 106638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 591 | 8 | 1 | 5 | 5.6 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3[nH]nc4c3CCCC4)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL316077 | 106638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 591 | 8 | 1 | 5 | 5.6 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3[nH]nc4c3CCCC4)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
44381758 | 11625 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 565 | 9 | 2 | 5 | 3.4 | CN1CCN(CCNC(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1181391 | 11625 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 565 | 9 | 2 | 5 | 3.4 | CN1CCN(CCNC(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL169440 | 11625 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 565 | 9 | 2 | 5 | 3.4 | CN1CCN(CCNC(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
44458096 | 84625 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 388 | 5 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(Cc2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL22417 | 84625 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 388 | 5 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(Cc2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
10009526 | 110014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 655 | 6 | 3 | 7 | 4.6 | O=C(Nc1cccc(-c2nn[nH]n2)c1)NC1N=C(c2ccccc2F)c2cccc(Cl)c2N(CC(=O)N2CC3CCC(CC3)C2)C1=O | 10.1016/s0960-894x(98)00237-6 | ||
CHEMBL32492 | 110014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 655 | 6 | 3 | 7 | 4.6 | O=C(Nc1cccc(-c2nn[nH]n2)c1)NC1N=C(c2ccccc2F)c2cccc(Cl)c2N(CC(=O)N2CC3CCC(CC3)C2)C1=O | 10.1016/s0960-894x(98)00237-6 | ||
54580296 | 61587 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774035 | 61587 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cn4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
10418081 | 109883 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 840 | 23 | 9 | 8 | 2.4 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL324219 | 109883 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 840 | 23 | 9 | 8 | 2.4 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
44293998 | 187840 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 6 | 2 | 5 | 5.3 | CC(=O)c1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL50215 | 187840 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 609 | 6 | 2 | 5 | 5.3 | CC(=O)c1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
90663995 | 106341 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 919 | 23 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144564 | 106341 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 919 | 23 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
10769902 | 204819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 8 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
CHEMBL88629 | 204819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 8 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
10769902 | 204819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 8 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL88629 | 204819 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 601 | 8 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10555804 | 111108 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 616 | 9 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)(OC)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL328285 | 111108 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 616 | 9 | 1 | 5 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3c[nH]c4ccccc34)(OC)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
11114520 | 114952 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=S)C[C@H]12 | 10.1021/jm010898i | ||
CHEMBL3350849 | 114952 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=S)C[C@H]12 | 10.1021/jm010898i | ||
19766167 | 58923 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL170293 | 58923 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
44381577 | 96188 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@H](CNN[C@@H](Cc1ccccc1)C(N)=O)CC(=O)O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL263525 | 96188 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@H](CNN[C@@H](Cc1ccccc1)C(N)=O)CC(=O)O | 10.1016/S0960-894X(00)80680-0 | ||
44330731 | 206503 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 946 | 25 | 9 | 11 | 0.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CC[C@H](NC(=O)CCc2ccc(OS(=O)(=O)O)cc2)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL98720 | 206503 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 946 | 25 | 9 | 11 | 0.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CC[C@H](NC(=O)CCc2ccc(OS(=O)(=O)O)cc2)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
10369805 | 100086 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL291458 | 100086 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
10073082 | 24933 | 1 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)C(NC(=O)Nc2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL134750 | 24933 | 1 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)C(NC(=O)Nc2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44578530 | 188101 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 556 | 5 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL504024 | 188101 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 556 | 5 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
90663980 | 106327 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)cc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144549 | 106327 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)cc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44301036 | 197027 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 695 | 8 | 4 | 6 | 5.4 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)c3ccccc3C)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL58154 | 197027 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 695 | 8 | 4 | 6 | 5.4 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)c3ccccc3C)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
44300864 | 200234 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 8 | 4 | 6 | 5.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)c3ccccc3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL60754 | 200234 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 8 | 4 | 6 | 5.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)c3ccccc3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
367892 | 9441 | 1 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
CHEMBL112222 | 9441 | 1 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
44349027 | 16647 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 7 | 3 | 5 | 2.9 | O=C(O)CCC(NC(=O)c1cnc2ccccc2c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL124732 | 16647 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 438 | 7 | 3 | 5 | 2.9 | O=C(O)CCC(NC(=O)c1cnc2ccccc2c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44349083 | 117560 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL340463 | 117560 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44336486 | 108871 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 669 | 8 | 2 | 6 | 6.5 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C3(C(F)(F)F)N=N3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL321915 | 108871 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 669 | 8 | 2 | 6 | 6.5 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C3(C(F)(F)F)N=N3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
73349789 | 105657 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 629 | 12 | 6 | 6 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)NO)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL313499 | 105657 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 629 | 12 | 6 | 6 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)NO)c1ccccc1 | 10.1021/jm00092a007 | ||
73346724 | 204368 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 13 | 5 | 9 | 5.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)NC1N=NN=N1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL85607 | 204368 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 681 | 13 | 5 | 9 | 5.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)NC1N=NN=N1)c1ccccc1 | 10.1021/jm00092a007 | ||
44311923 | 202796 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 421 | 4 | 2 | 3 | 4.0 | O=C(Cc1ccc(Cl)cc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL72570 | 202796 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 421 | 4 | 2 | 3 | 4.0 | O=C(Cc1ccc(Cl)cc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
14802536 | 156789 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CCCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2112694 | 156789 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CCCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL407753 | 156789 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CCCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
44356799 | 25859 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 4.7 | CN1C(=O)C(NC(=O)Nc2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135538 | 25859 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 4.7 | CN1C(=O)C(NC(=O)Nc2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10392870 | 28887 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 552 | 7 | 2 | 5 | 5.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)OCc2ccccc2)C1=O | 10.1021/jm00078a018 | ||
CHEMBL138122 | 28887 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 552 | 7 | 2 | 5 | 5.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)OCc2ccccc2)C1=O | 10.1021/jm00078a018 | ||
14208312 | 77469 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2092865 | 77469 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44356710 | 116111 | 6 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 426 | 4 | 2 | 4 | 3.9 | CC(=O)c1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL336765 | 116111 | 6 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 426 | 4 | 2 | 4 | 3.9 | CC(=O)c1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL285995 | 99430 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 741 | 16 | 6 | 11 | 4.5 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CCOC(=O)NCCCNCCSCc3csc(C=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
44280225 | 99501 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 743 | 15 | 4 | 7 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL286475 | 99501 | 0 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 743 | 15 | 4 | 7 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44334278 | 4632 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 515 | 9 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)N[C@H](CSCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL103457 | 4632 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 515 | 9 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)N[C@H](CSCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334224 | 4986 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 3.3 | Cc1cccc(NC(=O)N[C@H](COC(=O)N(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105303 | 4986 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 480 | 7 | 2 | 5 | 3.3 | Cc1cccc(NC(=O)N[C@H](COC(=O)N(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334176 | 5001 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 527 | 9 | 2 | 5 | 4.7 | Cc1cccc(NC(=O)N[C@H](CC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105404 | 5001 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 527 | 9 | 2 | 5 | 4.7 | Cc1cccc(NC(=O)N[C@H](CC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334438 | 108768 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 513 | 9 | 2 | 4 | 5.2 | Cc1cccc(NC(=O)N[C@@H](C(=O)N2CCC(C(=O)c3ccccc3)CC2)[C@@H](C)OCc2ccccc2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL321800 | 108768 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 513 | 9 | 2 | 4 | 5.2 | Cc1cccc(NC(=O)N[C@@H](C(=O)N2CCC(C(=O)c3ccccc3)CC2)[C@@H](C)OCc2ccccc2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334270 | 162935 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 8 | 2 | 4 | 3.5 | CC(=O)C1CCN(C(=O)[C@@H](COCc2ccccc2)NC(=O)Nc2cccc(C)c2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL420098 | 162935 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 8 | 2 | 4 | 3.5 | CC(=O)C1CCN(C(=O)[C@@H](COCc2ccccc2)NC(=O)Nc2cccc(C)c2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
44366601 | 42181 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 323 | 4 | 0 | 3 | 3.5 | O=C1CCN(C(=O)OCc2ccccc2)CC1Cc1ccccc1 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL149905 | 42181 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 323 | 4 | 0 | 3 | 3.5 | O=C1CCN(C(=O)OCc2ccccc2)CC1Cc1ccccc1 | 10.1016/0960-894X(94)80030-8 | ||
44382487 | 165084 | 0 | None | - | 0 | Mouse | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 518 | 10 | 4 | 4 | 2.7 | CC(C)C[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL424370 | 165084 | 0 | None | - | 0 | Mouse | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 518 | 10 | 4 | 4 | 2.7 | CC(C)C[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
44349023 | 16178 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 384 | 8 | 3 | 3 | 3.4 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00079a003 | ||
CHEMBL122922 | 16178 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 384 | 8 | 3 | 3 | 3.4 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00079a003 | ||
15167808 | 202844 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 4.1 | CN(C(=O)c1cc2ccccc2[nH]1)C1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL72894 | 202844 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 4.1 | CN(C(=O)c1cc2ccccc2[nH]1)C1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
19766230 | 30508 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 499 | 6 | 1 | 4 | 4.7 | COC(C(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C)(c1ccccc1)C(F)(F)F | 10.1021/jm00163a069 | ||
CHEMBL139520 | 30508 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 499 | 6 | 1 | 4 | 4.7 | COC(C(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C)(c1ccccc1)C(F)(F)F | 10.1021/jm00163a069 | ||
45481627 | 195021 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 419 | 7 | 4 | 4 | 2.7 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)C1=CC2CCCC2N1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL564796 | 195021 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 419 | 7 | 4 | 4 | 2.7 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)C1=CC2CCCC2N1 | 10.1016/j.bmc.2009.05.067 | ||
51353551 | 17950 | 10 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269257 | 17950 | 10 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
16100406 | 82811 | 0 | None | -33 | 4 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL218600 | 82811 | 0 | None | -33 | 4 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
10531224 | 167438 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 575 | 7 | 2 | 4 | 5.7 | CC(C)N(C(=O)CN1C(=O)C(C)(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
CHEMBL432015 | 167438 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 575 | 7 | 2 | 4 | 5.7 | CC(C)N(C(=O)CN1C(=O)C(C)(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
10531224 | 167438 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 575 | 7 | 2 | 4 | 5.7 | CC(C)N(C(=O)CN1C(=O)C(C)(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
CHEMBL432015 | 167438 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 575 | 7 | 2 | 4 | 5.7 | CC(C)N(C(=O)CN1C(=O)C(C)(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
11775012 | 196435 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 439 | 7 | 3 | 4 | 3.9 | O=C(NC(Cc1ccccc1)C(=O)O)c1ccccc1NC(=O)c1nccc2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL574530 | 196435 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 439 | 7 | 3 | 4 | 3.9 | O=C(NC(Cc1ccccc1)C(=O)O)c1ccccc1NC(=O)c1nccc2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
44287088 | 99748 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 838 | 22 | 7 | 7 | 5.6 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL288373 | 99748 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 838 | 22 | 7 | 7 | 5.6 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44396785 | 66842 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 530 | 7 | 2 | 5 | 4.6 | C[C@H]1C(=O)N(Cc2ccccc2)C(=O)N2CCC[C@@H](N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OC(C)(C)C)C12 | 10.1021/jm0498755 | ||
CHEMBL187732 | 66842 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 530 | 7 | 2 | 5 | 4.6 | C[C@H]1C(=O)N(Cc2ccccc2)C(=O)N2CCC[C@@H](N[C@@H](Cc3c[nH]c4ccccc34)C(=O)OC(C)(C)C)C12 | 10.1021/jm0498755 | ||
44303669 | 167726 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 573 | 10 | 4 | 5 | 3.9 | O=C(O)CCC(=O)N[C@@H](CNC(=O)C1(NC(=O)OC2C3CC4CC(C3)CC2C4)Cc2ccccc2C1)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL434020 | 167726 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 573 | 10 | 4 | 5 | 3.9 | O=C(O)CCC(=O)N[C@@H](CNC(=O)C1(NC(=O)OC2C3CC4CC(C3)CC2C4)Cc2ccccc2C1)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
44349069 | 117556 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL340413 | 117556 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
65987 | 99116 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 4.1 | O=C(O)CC[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL283820 | 99116 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 4.1 | O=C(O)CC[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
65987 | 99116 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 4.1 | O=C(O)CC[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1021/jm950372w | ||
CHEMBL283820 | 99116 | 9 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 440 | 6 | 2 | 3 | 4.1 | O=C(O)CC[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1021/jm950372w | ||
15281185 | 49189 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 484 | 5 | 2 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3cnccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL156484 | 49189 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 484 | 5 | 2 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3cnccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
10555164 | 112257 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 575 | 7 | 1 | 4 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(F)cc1 | 10.1021/jm970265x | ||
CHEMBL330521 | 112257 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 575 | 7 | 1 | 4 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(F)cc1 | 10.1021/jm970265x | ||
44359376 | 118854 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1O | 10.1021/jm970065l | ||
CHEMBL344380 | 118854 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1O | 10.1021/jm970065l | ||
10647112 | 162871 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 447 | 3 | 3 | 4 | 4.1 | Cc1cccc(NC(=O)N[C@@H]2N=C([C@H]3CCC(C)(C)CCN3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL419663 | 162871 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 447 | 3 | 3 | 4 | 4.1 | Cc1cccc(NC(=O)N[C@@H]2N=C([C@H]3CCC(C)(C)CCN3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
44211353 | 58744 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 552 | 9 | 2 | 5 | 3.5 | O=C(CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)NCCN1CCOCC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL169453 | 58744 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 552 | 9 | 2 | 5 | 3.5 | O=C(CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)NCCN1CCOCC1 | 10.1016/S0960-894X(00)80681-2 | ||
10484212 | 99417 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/s0960-894x(98)00237-6 | ||
CHEMBL285921 | 99417 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/s0960-894x(98)00237-6 | ||
CHEMBL355608 | 209992 | 0 | None | - | 0 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N1CC(=O)N[C@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
CHEMBL3142924 | 209392 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | COc1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||||
10484212 | 99417 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL285921 | 99417 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
9823890 | 26728 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 428 | 4 | 3 | 4 | 3.3 | CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136412 | 26728 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 428 | 4 | 3 | 4 | 3.3 | CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44578251 | 181850 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478604 | 181850 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
14991568 | 100244 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 847 | 20 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL292519 | 100244 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 847 | 20 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14991575 | 100317 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 852 | 20 | 10 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2cc(O)ccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL293026 | 100317 | 0 | None | - | 0 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 852 | 20 | 10 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2cc(O)ccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL434674 | 211912 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10675328 | 111017 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 617 | 9 | 1 | 6 | 5.7 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)(OC)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL327815 | 111017 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 617 | 9 | 1 | 6 | 5.7 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)(OC)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
46235271 | 73301 | 2 | None | - | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017835 | 73301 | 2 | None | - | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
44210424 | 118713 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 423 | 4 | 2 | 4 | 3.8 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL34335 | 118713 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 423 | 4 | 2 | 4 | 3.8 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
9868877 | 205932 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 8 | 2 | 4 | 3.8 | COc1cccc(N(CC(=O)N(C)c2ccccc2)C(=O)CNC(=O)Nc2cccc(C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9534 | 205932 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 8 | 2 | 4 | 3.8 | COc1cccc(N(CC(=O)N(C)c2ccccc2)C(=O)CNC(=O)Nc2cccc(C)c2)c1 | 10.1021/jm970373j | ||
10440992 | 160749 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 990 | 28 | 9 | 11 | 1.8 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL412238 | 160749 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 990 | 28 | 9 | 11 | 1.8 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
10440992 | 160749 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 990 | 28 | 9 | 11 | 1.8 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL412238 | 160749 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 990 | 28 | 9 | 11 | 1.8 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
44382735 | 120250 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 646 | 13 | 4 | 4 | 6.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL355275 | 120250 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 646 | 13 | 4 | 4 | 6.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL2079550 | 207449 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(C(F)(F)C(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
19910130 | 119286 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 439 | 14 | 3 | 3 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL348168 | 119286 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 439 | 14 | 3 | 3 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
44578562 | 180952 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc3c2OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476519 | 180952 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 530 | 4 | 0 | 6 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc3c2OCCO3)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
14991540 | 106319 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 855 | 23 | 8 | 9 | 3.2 | COc1ccc(CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
CHEMBL3144540 | 106319 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 855 | 23 | 8 | 9 | 3.2 | COc1ccc(CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
90663993 | 106339 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 901 | 21 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Br)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144562 | 106339 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 901 | 21 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Br)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
9828961 | 167423 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 548 | 6 | 4 | 4 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL431919 | 167423 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 548 | 6 | 4 | 4 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
44382709 | 58905 | 0 | None | - | 0 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 504 | 10 | 4 | 4 | 2.9 | CCCC[C@H](NC(=O)c1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL170207 | 58905 | 0 | None | - | 0 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 504 | 10 | 4 | 4 | 2.9 | CCCC[C@H](NC(=O)c1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
44368454 | 120702 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 549 | 4 | 3 | 7 | 3.5 | CC(C)C[C@]1(C)N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/jm020424z | ||
CHEMBL357749 | 120702 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 549 | 4 | 3 | 7 | 3.5 | CC(C)C[C@]1(C)N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/jm020424z | ||
14208264 | 101639 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 4.5 | CC(C)(C)c1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL302282 | 101639 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 4.5 | CC(C)(C)c1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
44382560 | 119811 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 660 | 14 | 4 | 4 | 6.5 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL352817 | 119811 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 660 | 14 | 4 | 4 | 6.5 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
44362745 | 32837 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL141655 | 32837 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
10030203 | 25686 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 540 | 6 | 2 | 6 | 2.8 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL135371 | 25686 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 540 | 6 | 2 | 6 | 2.8 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
44357031 | 28486 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 585 | 8 | 2 | 9 | 3.1 | COC(=O)[C@H]1CCCN1OC(=O)CN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137779 | 28486 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 585 | 8 | 2 | 9 | 3.1 | COC(=O)[C@H]1CCCN1OC(=O)CN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
3035433 | 99009 | 12 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 535 | 4 | 3 | 7 | 3.1 | CC(C)C[C@@H]1N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/np9800102 | ||
CHEMBL283117 | 99009 | 12 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 535 | 4 | 3 | 7 | 3.1 | CC(C)C[C@@H]1N[C@H]2N(C1=O)c1ccccc1[C@@]2(O)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccccc1c2=O | 10.1021/np9800102 | ||
44334177 | 109279 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 508 | 7 | 3 | 3 | 5.3 | Cc1cccc(NC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL323127 | 109279 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 508 | 7 | 3 | 3 | 5.3 | Cc1cccc(NC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
9983680 | 162772 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 506 | 7 | 2 | 5 | 3.8 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL418987 | 162772 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 506 | 7 | 2 | 5 | 3.8 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44349185 | 16354 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCCC2)C1 | 10.1021/jm00079a003 | ||
CHEMBL123720 | 16354 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCCC2)C1 | 10.1021/jm00079a003 | ||
13953698 | 101439 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 464 | 5 | 1 | 5 | 5.1 | CN(C)Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00396a028 | ||
CHEMBL300926 | 101439 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 464 | 5 | 1 | 5 | 5.1 | CN(C)Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00396a028 | ||
15614752 | 118244 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 549 | 6 | 3 | 5 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1CNCC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00163a069 | ||
CHEMBL341815 | 118244 | 0 | None | - | 0 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 549 | 6 | 3 | 5 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1CNCC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00163a069 | ||
44286977 | 99676 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 782 | 18 | 7 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL287712 | 99676 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 782 | 18 | 7 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
14208264 | 101639 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 4.5 | CC(C)(C)c1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL302282 | 101639 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 411 | 3 | 2 | 3 | 4.5 | CC(C)(C)c1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
10625001 | 28965 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 493 | 7 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(CO)CCCC1 | 10.1021/jm970065l | ||
CHEMBL138190 | 28965 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 493 | 7 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(CO)CCCC1 | 10.1021/jm970065l | ||
73349872 | 88771 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL2367718 | 88771 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL2367719 | 88771 | 1 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 616 | 12 | 5 | 5 | 5.2 | CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)N[C@](C)(Cc1c[nH]c3ccccc13)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1)C2 | 10.1016/S0960-894X(97)00107-8 | ||
44376113 | 119456 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 494 | 6 | 3 | 6 | 3.9 | CC(C)CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL349730 | 119456 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 494 | 6 | 3 | 6 | 3.9 | CC(C)CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
10369803 | 16405 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 7 | 3 | 3 | 5.7 | CCC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
CHEMBL123951 | 16405 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 7 | 3 | 3 | 5.7 | CCC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
10481751 | 112592 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 518 | 5 | 3 | 3 | 5.3 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
CHEMBL331315 | 112592 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 518 | 5 | 3 | 3 | 5.3 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
11741648 | 26154 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccncc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL135909 | 26154 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccncc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
3452843 | 119020 | 13 | None | - | 10 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL345686 | 119020 | 13 | None | - | 10 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
122130 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1016/0960-894X(95)00556-9 | ||
888 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL115121 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1016/0960-894X(95)00556-9 | ||
122130 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1021/jm960669+ | ||
888 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1021/jm960669+ | ||
CHEMBL115121 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 10.1021/jm960669+ | ||
44283150 | 164693 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 529 | 9 | 3 | 4 | 4.7 | CN(C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(CO)Cc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL422941 | 164693 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 529 | 9 | 3 | 4 | 4.7 | CN(C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(CO)Cc1ccccc1 | 10.1021/jm00086a017 | ||
15104604 | 108976 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 448 | 13 | 2 | 3 | 5.1 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccnc1 | 10.1021/jm00116a002 | ||
CHEMBL322031 | 108976 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 448 | 13 | 2 | 3 | 5.1 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccnc1 | 10.1021/jm00116a002 | ||
44359338 | 168101 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CC2CCC1C2 | 10.1021/jm970065l | ||
CHEMBL436411 | 168101 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 489 | 6 | 3 | 3 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CC2CCC1C2 | 10.1021/jm970065l | ||
11755707 | 57218 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.7 | CCOC(=O)c1cccc(NC(=O)NCc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL166168 | 57218 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 500 | 8 | 2 | 7 | 4.7 | CCOC(=O)c1cccc(NC(=O)NCc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1016/S0960-894X(97)00108-X | ||
10345812 | 18463 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1ccccc1NC(=O)N[C@@H]1C[C@H](c2ccccc2)c2ccccc2N(CC(=O)NC(C)(C)C)C1=O | 10.1021/jm00048a015 | ||
CHEMBL127687 | 18463 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1ccccc1NC(=O)N[C@@H]1C[C@H](c2ccccc2)c2ccccc2N(CC(=O)NC(C)(C)C)C1=O | 10.1021/jm00048a015 | ||
42636923 | 178253 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL469341 | 178253 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
15689733 | 106132 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||
CHEMBL3142905 | 106132 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||
52943046 | 17954 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 557 | 8 | 0 | 6 | 5.8 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Oc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269262 | 17954 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 557 | 8 | 0 | 6 | 5.8 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Oc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
14208305 | 67402 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907846 | 67402 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2cccc(I)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208248 | 202935 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
CHEMBL73561 | 202935 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
10897104 | 78185 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 573 | 7 | 3 | 5 | 4.7 | C[C@H](c1ccccc1)N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
CHEMBL2112237 | 78185 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 573 | 7 | 3 | 5 | 4.7 | C[C@H](c1ccccc1)N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
14991582 | 199564 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 871 | 21 | 7 | 8 | 4.3 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(Cl)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL60385 | 199564 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 871 | 21 | 7 | 8 | 4.3 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(Cl)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14208248 | 202935 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00047a021 | ||
CHEMBL73561 | 202935 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00047a021 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10008654 | 127094 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
71456294 | 79248 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL2115133 | 79248 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
136055866 | 56223 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 468 | 4 | 3 | 7 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3noc(O)n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL163610 | 56223 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 468 | 4 | 3 | 7 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3noc(O)n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
10509945 | 88954 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL2369816 | 88954 | 0 | None | - | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44215880 | 69065 | 0 | None | - | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933100 | 69065 | 0 | None | - | 2 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10507561 | 120488 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 585 | 7 | 2 | 4 | 5.4 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
CHEMBL356408 | 120488 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 585 | 7 | 2 | 4 | 5.4 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
CHEMBL2372623 | 208532 | 0 | None | -16 | 4 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
44310934 | 202699 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 575 | 7 | 3 | 6 | 4.1 | COc1ccc(N2C(=O)CC3C(NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
CHEMBL71996 | 202699 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 575 | 7 | 3 | 6 | 4.1 | COc1ccc(N2C(=O)CC3C(NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
10462874 | 98380 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 766 | 16 | 6 | 5 | 7.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCCNC(=O)Nc1ccccc1Cl | 10.1016/s0960-894x(00)00198-0 | ||
CHEMBL278780 | 98380 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 766 | 16 | 6 | 5 | 7.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCCNC(=O)Nc1ccccc1Cl | 10.1016/s0960-894x(00)00198-0 | ||
15666987 | 206456 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL98446 | 206456 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 976 | 29 | 10 | 11 | 1.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
15667019 | 206488 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 905 | 26 | 9 | 10 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL98631 | 206488 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 905 | 26 | 9 | 10 | 2.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
14208217 | 202449 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 3 | 2 | 4 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccsc1 | 10.1021/jm00120a002 | ||
CHEMBL70550 | 202449 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 3 | 2 | 4 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccsc1 | 10.1021/jm00120a002 | ||
44381914 | 12893 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 522 | 14 | 1 | 4 | 4.7 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1189721 | 12893 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 522 | 14 | 1 | 4 | 4.7 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL539320 | 12893 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 522 | 14 | 1 | 4 | 4.7 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80681-2 | ||
73354295 | 105466 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 643 | 13 | 5 | 6 | 4.5 | CONC(=O)CCC(=O)N[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL312894 | 105466 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 643 | 13 | 5 | 6 | 4.5 | CONC(=O)CCC(=O)N[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1021/jm00092a007 | ||
44311626 | 202443 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 4 | 2 | 4 | 4.8 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(SC(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
CHEMBL70499 | 202443 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 4 | 2 | 4 | 4.8 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(SC(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
15104623 | 9925 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1cccc(C)c1 | 10.1021/jm00116a002 | ||
CHEMBL114997 | 9925 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1cccc(C)c1 | 10.1021/jm00116a002 | ||
15104625 | 110033 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 651 | 16 | 2 | 6 | 8.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c(Sc2ccccc2[N+](=O)[O-])[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL325067 | 110033 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 651 | 16 | 2 | 6 | 8.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c(Sc2ccccc2[N+](=O)[O-])[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
44334225 | 4919 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 522 | 7 | 2 | 6 | 3.1 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCOCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL104958 | 4919 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 522 | 7 | 2 | 6 | 3.1 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCOCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
71452639 | 78042 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 542 | 9 | 2 | 5 | 4.0 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCN(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL2111654 | 78042 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 542 | 9 | 2 | 5 | 4.0 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCN(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
10673078 | 28874 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 6 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1C#N | 10.1021/jm970065l | ||
CHEMBL138112 | 28874 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 502 | 6 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1C#N | 10.1021/jm970065l | ||
CHEMBL406978 | 210884 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||||
CHEMBL2372073 | 208435 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
44359840 | 164896 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 395 | 4 | 2 | 5 | 3.5 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1CNc1cnc(Cl)cn1 | 10.1021/jm00163a069 | ||
CHEMBL423918 | 164896 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 395 | 4 | 2 | 5 | 3.5 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1CNc1cnc(Cl)cn1 | 10.1021/jm00163a069 | ||
44280373 | 98929 | 0 | None | - | 1 | Mouse | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL282646 | 98929 | 0 | None | - | 1 | Mouse | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
10839347 | 30047 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 507 | 7 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(CO)CCCCC1 | 10.1021/jm970065l | ||
CHEMBL139101 | 30047 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 507 | 7 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(CO)CCCCC1 | 10.1021/jm970065l | ||
45482481 | 196200 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL572649 | 196200 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10156187 | 102632 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00120a002 | ||
CHEMBL307659 | 102632 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00120a002 | ||
10156187 | 102632 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00047a021 | ||
CHEMBL307659 | 102632 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00047a021 | ||
10249484 | 22453 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2ccncc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL132699 | 22453 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2ccncc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10672231 | 204241 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 475 | 5 | 3 | 4 | 4.9 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL84433 | 204241 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 475 | 5 | 3 | 4 | 4.9 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
14208195 | 15090 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 4 | 2 | 4 | 4.8 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(SC(F)(F)F)c1 | 10.1021/jm00047a021 | ||
CHEMBL121210 | 15090 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 455 | 4 | 2 | 4 | 4.8 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(SC(F)(F)F)c1 | 10.1021/jm00047a021 | ||
10673570 | 29942 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 521 | 7 | 4 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(C(=O)O)CCCCC1 | 10.1021/jm970065l | ||
CHEMBL139001 | 29942 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 521 | 7 | 4 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1(C(=O)O)CCCCC1 | 10.1021/jm970065l | ||
10719765 | 77958 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 487 | 6 | 4 | 7 | 3.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CNc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL2110202 | 77958 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 487 | 6 | 4 | 7 | 3.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CNc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm9506736 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
44368562 | 121449 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 588 | 12 | 5 | 5 | 4.3 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL359076 | 121449 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 588 | 12 | 5 | 5 | 4.3 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10698109 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
CHEMBL317181 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
10698109 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
CHEMBL317181 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
10790099 | 205543 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1ccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)cc1 | 10.1021/jm970373j | ||
CHEMBL9311 | 205543 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1ccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)cc1 | 10.1021/jm970373j | ||
44341327 | 162780 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 504 | 13 | 3 | 2 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL419031 | 162780 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 504 | 13 | 3 | 2 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00116a002 | ||
15637206 | 78491 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 428 | 4 | 3 | 4 | 3.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(C(=O)O)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL2112932 | 78491 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 428 | 4 | 3 | 4 | 3.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(C(=O)O)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
9866980 | 4588 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 423 | 3 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N3C[C@H](C)N=C23)c1 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL103119 | 4588 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 423 | 3 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N3C[C@H](C)N=C23)c1 | 10.1016/0960-894X(95)00530-0 | ||
10577834 | 116244 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 518 | 6 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CC2CCC(CC2)C1 | 10.1021/jm970065l | ||
CHEMBL337529 | 116244 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 518 | 6 | 3 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CC2CCC(CC2)C1 | 10.1021/jm970065l | ||
10768419 | 28895 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 525 | 10 | 5 | 5 | 3.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(CC(=O)O)CC(=O)O | 10.1021/jm970065l | ||
CHEMBL138127 | 28895 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 525 | 10 | 5 | 5 | 3.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(CC(=O)O)CC(=O)O | 10.1021/jm970065l | ||
15291593 | 112354 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 537 | 6 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL330933 | 112354 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 537 | 6 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
5311201 | 205663 | 30 | None | -1174 | 6 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00001a027 | ||
CHEMBL9387 | 205663 | 30 | None | -1174 | 6 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00001a027 | ||
14208215 | 103323 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc2ccccc12 | 10.1021/jm00047a021 | ||
CHEMBL309017 | 103323 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc2ccccc12 | 10.1021/jm00047a021 | ||
10531430 | 111855 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccccc1N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)C(C)C | 10.1021/jm970265x | ||
CHEMBL329407 | 111855 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccccc1N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)C(C)C | 10.1021/jm970265x | ||
10391834 | 37990 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 516 | 11 | 3 | 4 | 4.5 | CC(C)N(C(=O)CN(C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
CHEMBL146206 | 37990 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 516 | 11 | 3 | 4 | 4.5 | CC(C)N(C(=O)CN(C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
45482491 | 196733 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576957 | 196733 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44283151 | 118662 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 531 | 9 | 4 | 4 | 5.6 | O=C(NC(Cc1c[nH]c2ccccc12)/C(S)=N/C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL34300 | 118662 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 531 | 9 | 4 | 4 | 5.6 | O=C(NC(Cc1c[nH]c2ccccc12)/C(S)=N/C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
15689739 | 106110 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142683 | 106110 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
15689738 | 106121 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142705 | 106121 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL98468 | 214150 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | Cc1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00113a023 | ||||
44286653 | 147053 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 794 | 17 | 7 | 7 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CC(=O)N([C@@H](Cc2ccccc2)C(N)=O)C1 | 10.1021/jm00037a005 | ||
CHEMBL39310 | 147053 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 794 | 17 | 7 | 7 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CC(=O)N([C@@H](Cc2ccccc2)C(N)=O)C1 | 10.1021/jm00037a005 | ||
CHEMBL98468 | 214150 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | Cc1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||||
CHEMBL98468 | 214150 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | Cc1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00173a006 | ||||
44381479 | 59212 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 824 | 21 | 8 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL171593 | 59212 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 824 | 21 | 8 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
44458112 | 98254 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL277661 | 98254 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL2310857 | 207744 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N1CC(OS(=O)(=O)O)C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||||
44578422 | 180980 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5n4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476739 | 180980 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5n4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
90663974 | 106314 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144536 | 106314 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
155550911 | 173356 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1884 | 70 | 16 | 23 | 3.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4540877 | 173356 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 1884 | 70 | 16 | 23 | 3.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL160753 | 207066 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
54586174 | 61586 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774034 | 61586 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
11801911 | 111027 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 613 | 8 | 1 | 5 | 6.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C2CCCC2)cc1 | 10.1021/jm970265x | ||
CHEMBL327849 | 111027 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 613 | 8 | 1 | 5 | 6.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C2CCCC2)cc1 | 10.1021/jm970265x | ||
15689728 | 106119 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1c(Cl)cccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142703 | 106119 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1c(Cl)cccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
44336583 | 109555 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 665 | 9 | 2 | 5 | 6.6 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)c3ccccc3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL323512 | 109555 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 665 | 9 | 2 | 5 | 6.6 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)c3ccccc3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
44293971 | 188446 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 611 | 6 | 3 | 5 | 4.8 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(C(=O)O)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL50926 | 188446 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 611 | 6 | 3 | 5 | 4.8 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(C(=O)O)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
9802550 | 118671 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 426 | 4 | 2 | 3 | 4.4 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
CHEMBL343066 | 118671 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 426 | 4 | 2 | 3 | 4.4 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
10047370 | 78407 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 4 | 3 | 4 | 3.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CN)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2112754 | 78407 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 4 | 3 | 4 | 3.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CN)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44578529 | 182192 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 530 | 7 | 0 | 5 | 6.8 | CCCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479030 | 182192 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 530 | 7 | 0 | 5 | 6.8 | CCCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
14991544 | 106322 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 857 | 22 | 10 | 10 | 2.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(O)c(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144543 | 106322 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 857 | 22 | 10 | 10 | 2.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(O)c(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44381481 | 120122 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 3.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNN[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL354670 | 120122 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 3.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNN[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
14208288 | 67341 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 349 | 2 | 1 | 3 | 3.0 | CN1C(=O)[C@@H](NC(=O)C(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907660 | 67341 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 349 | 2 | 1 | 3 | 3.0 | CN1C(=O)[C@@H](NC(=O)C(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14208215 | 103323 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc2ccccc12 | 10.1021/jm00120a002 | ||
CHEMBL309017 | 103323 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc2ccccc12 | 10.1021/jm00120a002 | ||
10673039 | 57956 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 501 | 5 | 3 | 7 | 3.8 | Cc1ccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)cc1N(C)c1nn[nH]n1 | 10.1021/jm9506736 | ||
CHEMBL168253 | 57956 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 501 | 5 | 3 | 7 | 3.8 | Cc1ccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)cc1N(C)c1nn[nH]n1 | 10.1021/jm9506736 | ||
162672110 | 182278 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 848 | 22 | 9 | 9 | 2.0 | CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.0c00530 | ||
CHEMBL4791620 | 182278 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 848 | 22 | 9 | 9 | 2.0 | CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.0c00530 | ||
132980 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm9608523 | ||
881 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm9608523 | ||
CHEMBL420783 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm9608523 | ||
44348850 | 17766 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 986 | 24 | 11 | 11 | 2.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL126008 | 17766 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 986 | 24 | 11 | 11 | 2.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
3040489 | 44310 | 1 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 318 | 4 | 1 | 2 | 3.8 | O=C1CCN(Cc2ccccc2)CC1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL151990 | 44310 | 1 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 318 | 4 | 1 | 2 | 3.8 | O=C1CCN(Cc2ccccc2)CC1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
15167783 | 67380 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 409 | 4 | 3 | 3 | 4.3 | O=C(O)c1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)C(=O)Nc2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907735 | 67380 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 409 | 4 | 3 | 3 | 4.3 | O=C(O)c1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)C(=O)Nc2ccccc21 | 10.1021/jm00390a019 | ||
44370406 | 49617 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 529 | 16 | 2 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCc1ccccc1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL156814 | 49617 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 529 | 16 | 2 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCc1ccccc1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
132980 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm00032a002 | ||
881 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm00032a002 | ||
CHEMBL420783 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1021/jm00032a002 | ||
132980 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1016/0960-894X(95)00530-0 | ||
881 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL420783 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 10.1016/0960-894X(95)00530-0 | ||
71456223 | 78356 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1006 | 25 | 11 | 11 | 1.8 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CCCC[C@@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL2112635 | 78356 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1006 | 25 | 11 | 11 | 1.8 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CCCC[C@@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
10530003 | 96555 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CCNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL266598 | 96555 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CCNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
44283031 | 99527 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 613 | 13 | 2 | 5 | 6.4 | CCOC(=O)CCC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL286664 | 99527 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 613 | 13 | 2 | 5 | 6.4 | CCOC(=O)CCC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10530003 | 96555 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CCNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL266598 | 96555 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CCNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
136000594 | 61538 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 517 | 4 | 2 | 7 | 5.0 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc(O)c(O)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773890 | 61538 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 517 | 4 | 2 | 7 | 5.0 | Cc1ccc(-c2nc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)ncc2-c2ccc(O)c(O)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
44379911 | 58565 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 442 | 6 | 2 | 5 | 4.8 | Cc1cccc(NC(=O)NCc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL168875 | 58565 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 442 | 6 | 2 | 5 | 4.8 | Cc1cccc(NC(=O)NCc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1016/S0960-894X(97)00108-X | ||
136060576 | 87064 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 571 | 5 | 1 | 5 | 8.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(-c4ccccc4)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL233457 | 87064 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 571 | 5 | 1 | 5 | 8.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(-c4ccccc4)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
10071178 | 74146 | 1 | None | - | 2 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL202861 | 74146 | 1 | None | - | 2 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
54580265 | 61532 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccccc1-c1cnc(C(=O)N2CCN(c3cnc4ccccc4c3)CC2)nc1-c1ccc(C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773884 | 61532 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccccc1-c1cnc(C(=O)N2CCN(c3cnc4ccccc4c3)CC2)nc1-c1ccc(C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
15104632 | 110051 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 520 | 9 | 3 | 5 | 4.5 | CCOC(=O)[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
CHEMBL325161 | 110051 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 520 | 9 | 3 | 5 | 4.5 | CCOC(=O)[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
11734332 | 78182 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 6 | 3 | 5 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(C3CCCCC3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
CHEMBL2112233 | 78182 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 551 | 6 | 3 | 5 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(C3CCCCC3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
10047411 | 28393 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
CHEMBL137684 | 28393 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
71459887 | 78073 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1006 | 25 | 11 | 11 | 1.8 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1CCCC[C@@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL2111823 | 78073 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1006 | 25 | 11 | 11 | 1.8 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1CCCC[C@@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
155542545 | 172549 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1770 | 70 | 16 | 21 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4520699 | 172549 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1770 | 70 | 16 | 21 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44281204 | 99388 | 0 | None | - | 1 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 871 | 18 | 4 | 10 | 5.5 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCCN3CCN(C(=O)CNCCCOc4cccc(CN5CCCCC5)c4)CC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL285719 | 99388 | 0 | None | - | 1 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 871 | 18 | 4 | 10 | 5.5 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCCN3CCN(C(=O)CNCCCOc4cccc(CN5CCCCC5)c4)CC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
10649296 | 30560 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 507 | 6 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H]1CCCCC[C@@H]1O | 10.1021/jm970065l | ||
CHEMBL139601 | 30560 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 507 | 6 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H]1CCCCC[C@@H]1O | 10.1021/jm970065l | ||
10391769 | 17556 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 6 | 3 | 4 | 4.7 | COc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
CHEMBL125863 | 17556 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 6 | 3 | 4 | 4.7 | COc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
10601831 | 96057 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 511 | 6 | 3 | 7 | 5.0 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2Cl)c1 | 10.1021/jm970373j | ||
CHEMBL262569 | 96057 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 511 | 6 | 3 | 7 | 5.0 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2Cl)c1 | 10.1021/jm970373j | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10047172 | 78405 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 410 | 4 | 2 | 3 | 4.3 | C=Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL2112752 | 78405 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 410 | 4 | 2 | 3 | 4.3 | C=Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
70689619 | 73291 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 6 | 1 | 5 | 6.5 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017825 | 73291 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 592 | 6 | 1 | 5 | 6.5 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
46235271 | 73301 | 2 | None | - | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | - | 2 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
44592045 | 178327 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(O)CC(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL469979 | 178327 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(O)CC(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
14208252 | 67411 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL1907854 | 67411 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
14208256 | 202824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 433 | 5 | 2 | 5 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1OC | 10.1021/jm00047a021 | ||
CHEMBL72727 | 202824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 433 | 5 | 2 | 5 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1OC | 10.1021/jm00047a021 | ||
10341247 | 119585 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 405 | 2 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(N3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL350853 | 119585 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 405 | 2 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(N3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
44286672 | 99910 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 836 | 18 | 6 | 7 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL289804 | 99910 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 836 | 18 | 6 | 7 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
52946666 | 17952 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269260 | 17952 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
10056643 | 108720 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 918 | 21 | 8 | 8 | 5.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL321653 | 108720 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 918 | 21 | 8 | 8 | 5.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
44293810 | 101283 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 581 | 5 | 2 | 4 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL299800 | 101283 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 581 | 5 | 2 | 4 | 5.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
44578399 | 181372 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 492 | 5 | 1 | 6 | 4.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4nc5ccccc5[nH]4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL477996 | 181372 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 492 | 5 | 1 | 6 | 4.7 | COc1cccc(-n2cc(C(=O)N3CCN(c4nc5ccccc5[nH]4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44382329 | 120114 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@H](c2ccccc2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL354633 | 120114 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@H](c2ccccc2)[C@H]1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
10603713 | 111157 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4cccc(F)c34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL328586 | 111157 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4cccc(F)c34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10770092 | 111042 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 614 | 8 | 0 | 5 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3cn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL327909 | 111042 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 614 | 8 | 0 | 5 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3cn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
54582287 | 61540 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 5 | 0 | 6 | 5.3 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773892 | 61540 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 5 | 0 | 6 | 5.3 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
15689725 | 106120 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142704 | 106120 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142689 | 209385 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | None | None | None | CC(C)(C)NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
44458114 | 84974 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 393 | 4 | 2 | 4 | 2.2 | O=C(N[C@@H]1C(=O)N(c2ccccc2F)C[C@@H]1C(=O)O)c1cnc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL22630 | 84974 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 393 | 4 | 2 | 4 | 2.2 | O=C(N[C@@H]1C(=O)N(c2ccccc2F)C[C@@H]1C(=O)O)c1cnc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
3960 | 2313 | 20 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1039/C6MD00052E | ||
891 | 2313 | 20 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1039/C6MD00052E | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1039/C6MD00052E | ||
10463229 | 119304 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 840 | 20 | 9 | 8 | 3.8 | CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00031a013 | ||
CHEMBL348346 | 119304 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 840 | 20 | 9 | 8 | 3.8 | CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)Nc1ccccc1C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00031a013 | ||
14888714 | 76896 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1067 | 30 | 11 | 12 | 0.9 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(C(F)(F)C(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079602 | 76896 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 1067 | 30 | 11 | 12 | 0.9 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(C(F)(F)C(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
44370461 | 119061 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL346070 | 119061 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
10075097 | 28432 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 511 | 6 | 2 | 5 | 3.6 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL137726 | 28432 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 511 | 6 | 2 | 5 | 3.6 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1021/jm00078a018 | ||
19766160 | 58201 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 456 | 4 | 2 | 3 | 3.9 | O=C(Nc1cccc2ccccc12)NC1CCc2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL168386 | 58201 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 456 | 4 | 2 | 3 | 3.9 | O=C(Nc1cccc2ccccc12)NC1CCc2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1016/S0960-894X(00)80683-6 | ||
71449079 | 78217 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 639 | 11 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)Cc1cc(O)no1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112334 | 78217 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 639 | 11 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)Cc1cc(O)no1)c1ccccc1 | 10.1021/jm00092a007 | ||
73348230 | 204639 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 634 | 11 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CP(C)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL87470 | 204639 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 634 | 11 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CP(C)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
14208252 | 67411 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907854 | 67411 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14208256 | 202824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 433 | 5 | 2 | 5 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1OC | 10.1021/jm00120a002 | ||
CHEMBL72727 | 202824 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 433 | 5 | 2 | 5 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1OC | 10.1021/jm00120a002 | ||
15104631 | 112350 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 9 | 3 | 5 | 4.5 | CCOC(=O)[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
CHEMBL330918 | 112350 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 520 | 9 | 3 | 5 | 4.5 | CCOC(=O)[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
44280114 | 5041 | 0 | None | 1 | 2 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105618 | 5041 | 0 | None | 1 | 2 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
14208197 | 202931 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 537 | 6 | 4 | 5 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL73535 | 202931 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 537 | 6 | 4 | 5 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
15614734 | 67375 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 411 | 3 | 0 | 3 | 4.7 | CN1C(=O)[C@@H](Cc2cn(C)c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907729 | 67375 | 0 | None | - | 0 | Guinea pig | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 411 | 3 | 0 | 3 | 4.7 | CN1C(=O)[C@@H](Cc2cn(C)c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
10031700 | 12084 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 486 | 7 | 2 | 4 | 3.7 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC[N+](C)(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL1184246 | 12084 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 486 | 7 | 2 | 4 | 3.7 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC[N+](C)(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL340975 | 12084 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 486 | 7 | 2 | 4 | 3.7 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC[N+](C)(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
10007047 | 16742 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 524 | 5 | 3 | 3 | 5.8 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](C2CCCCC2)c2ccccc21 | 10.1021/jm00048a015 | ||
CHEMBL125253 | 16742 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 524 | 5 | 3 | 3 | 5.8 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](C2CCCCC2)c2ccccc21 | 10.1021/jm00048a015 | ||
44381641 | 168076 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL436253 | 168076 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
10646538 | 96918 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 435 | 6 | 3 | 6 | 4.1 | CC(C)Oc1cccc(-n2c(NNC(=O)NC3CCCCC3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL269606 | 96918 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 435 | 6 | 3 | 6 | 4.1 | CC(C)Oc1cccc(-n2c(NNC(=O)NC3CCCCC3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
54586149 | 61542 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(C)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773894 | 61542 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(C)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
9853654 | 22588 | 37 | None | - | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00079a003 | ||
CHEMBL1328 | 22588 | 37 | None | - | 2 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00079a003 | ||
44318235 | 11971 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 513 | 7 | 2 | 4 | 3.0 | CCN(CC)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C(c2cccc[n+]2C)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL1183721 | 11971 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 513 | 7 | 2 | 4 | 3.0 | CCN(CC)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C(c2cccc[n+]2C)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL314846 | 11971 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 513 | 7 | 2 | 4 | 3.0 | CCN(CC)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C(c2cccc[n+]2C)c2ccccc21 | 10.1021/jm9608523 | ||
10369805 | 100086 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL291458 | 100086 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
14208266 | 103901 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 3 | 3 | 4 | 2.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL310250 | 103901 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 3 | 3 | 4 | 2.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(O)cc1 | 10.1021/jm00047a021 | ||
45482484 | 196303 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 455 | 9 | 4 | 3 | 4.2 | O=C(CCc1c[nH]c2ccccc12)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL573555 | 196303 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 455 | 9 | 4 | 3 | 4.2 | O=C(CCc1c[nH]c2ccccc12)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1016/j.bmc.2009.05.067 | ||
9953071 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL58699 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
9953071 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
CHEMBL58699 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
71460027 | 79305 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)C(=Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL2115544 | 79305 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)C(=Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
10009450 | 99404 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 649 | 7 | 3 | 7 | 4.5 | CCc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/s0960-894x(98)00237-6 | ||
CHEMBL285850 | 99404 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 649 | 7 | 3 | 7 | 4.5 | CCc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/s0960-894x(98)00237-6 | ||
14208259 | 202456 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 545 | 4 | 1 | 4 | 5.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2N(C(=O)c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
CHEMBL70593 | 202456 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 545 | 4 | 1 | 4 | 5.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2N(C(=O)c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
10260012 | 109161 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 858 | 22 | 8 | 7 | 3.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL322391 | 109161 | 0 | None | - | 0 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 858 | 22 | 8 | 7 | 3.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
3960 | 2313 | 20 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
891 | 2313 | 20 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44359879 | 32804 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 445 | 7 | 1 | 5 | 4.4 | COC(=O)CC(NCC1CN=C(c2ccccc2F)c2ccccc2N1C)c1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL141629 | 32804 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 445 | 7 | 1 | 5 | 4.4 | COC(=O)CC(NCC1CN=C(c2ccccc2F)c2ccccc2N1C)c1ccccc1 | 10.1021/jm00163a069 | ||
44458049 | 98640 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 363 | 4 | 3 | 3 | 2.0 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL280733 | 98640 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 363 | 4 | 3 | 3 | 2.0 | O=C(N[C@@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
44372113 | 10173 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1105 | 30 | 11 | 13 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC | 10.1021/jm00031a013 | ||
CHEMBL1161390 | 10173 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1105 | 30 | 11 | 13 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC | 10.1021/jm00031a013 | ||
10369805 | 100086 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL291458 | 100086 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
15104630 | 9474 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 462 | 7 | 3 | 3 | 4.9 | C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
CHEMBL112387 | 9474 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 462 | 7 | 3 | 3 | 4.9 | C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
44362746 | 118486 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL342520 | 118486 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
10252412 | 25568 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 435 | 3 | 2 | 4 | 4.2 | CN1C(=O)C(NC(=O)Nc2ccc3ccccc3n2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135289 | 25568 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 435 | 3 | 2 | 4 | 4.2 | CN1C(=O)C(NC(=O)Nc2ccc3ccccc3n2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991537 | 106313 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 921 | 24 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1cccc(OS(=O)(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144535 | 106313 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 921 | 24 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1cccc(OS(=O)(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3143668 | 209433 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O | 10.1016/0960-894X(96)00160-6 | ||||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a068 | ||||
44381749 | 12789 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 540 | 14 | 1 | 4 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1188959 | 12789 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 540 | 14 | 1 | 4 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL537834 | 12789 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 540 | 14 | 1 | 4 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCN(C)CC1)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||||
CHEMBL64605 | 214079 | 6 | None | - | 3 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050689o | ||||
14208266 | 103901 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 3 | 3 | 4 | 2.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL310250 | 103901 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 3 | 3 | 4 | 2.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.0c00530 | ||||
9953071 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL58699 | 197387 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 404 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||||
44334258 | 4398 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 451 | 8 | 3 | 4 | 3.5 | Cc1cccc(NC(=O)N[C@H](CCC(=O)O)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL101752 | 4398 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 451 | 8 | 3 | 4 | 3.5 | Cc1cccc(NC(=O)N[C@H](CCC(=O)O)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334452 | 4491 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 497 | 9 | 2 | 3 | 5.6 | Cc1cccc(NC(=O)N[C@H](CCCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL102461 | 4491 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 497 | 9 | 2 | 3 | 5.6 | Cc1cccc(NC(=O)N[C@H](CCCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||||
15673181 | 85569 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 629 | 12 | 6 | 6 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)NO)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304156 | 85569 | 0 | None | - | 0 | Rat | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 629 | 12 | 6 | 6 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)NO)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
44354125 | 22949 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL133101 | 22949 | 0 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
14802539 | 76199 | 1 | None | - | 1 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL2062144 | 76199 | 1 | None | - | 1 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
44286962 | 100012 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 810 | 21 | 8 | 7 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL290896 | 100012 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 810 | 21 | 8 | 7 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44368521 | 46033 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 576 | 12 | 5 | 5 | 4.6 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL153557 | 46033 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 576 | 12 | 5 | 5 | 4.6 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
23844130 | 10019 | 12 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 484 | 5 | 3 | 6 | 3.6 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL115612 | 10019 | 12 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 484 | 5 | 3 | 6 | 3.6 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
45482479 | 196167 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 461 | 7 | 4 | 3 | 4.5 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc(Cl)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL572412 | 196167 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 461 | 7 | 4 | 3 | 4.5 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc(Cl)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
71719689 | 85562 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 500 | 8 | 3 | 4 | 4.8 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccn1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL2304063 | 85562 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 500 | 8 | 3 | 4 | 4.8 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccn1 | 10.1016/S0960-894X(01)80769-1 | ||
44381925 | 12743 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 538 | 11 | 2 | 4 | 4.5 | CCN(CC)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1188615 | 12743 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 538 | 11 | 2 | 4 | 4.5 | CCN(CC)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL536938 | 12743 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 538 | 11 | 2 | 4 | 4.5 | CCN(CC)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
5311347 | 106872 | 3 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL317675 | 106872 | 3 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
5311347 | 32807 | 3 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL141630 | 32807 | 3 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
5311347 | 106872 | 3 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL317675 | 106872 | 3 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
5311347 | 32807 | 3 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL141630 | 32807 | 3 | None | - | 1 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm970065l | ||
45482097 | 196685 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(NC(Cc1ccccc1)C(=O)O)c1ccccc1NC(=O)c1c[nH]c2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576584 | 196685 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(NC(Cc1ccccc1)C(=O)O)c1ccccc1NC(=O)c1c[nH]c2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44349024 | 16950 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 402 | 8 | 3 | 3 | 3.5 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL125551 | 16950 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 402 | 8 | 3 | 3 | 3.5 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00079a003 | ||
44381851 | 119872 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL353305 | 119872 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)O | 10.1016/S0960-894X(97)00107-8 | ||
44283500 | 138733 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 516 | 9 | 3 | 5 | 4.8 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OC(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL37903 | 138733 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 516 | 9 | 3 | 5 | 4.8 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OC(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
11753772 | 25786 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 455 | 6 | 2 | 4 | 3.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCN(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL135447 | 25786 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 455 | 6 | 2 | 4 | 3.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCN(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
15689734 | 106127 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00113a023 | ||
CHEMBL3142899 | 106127 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00113a023 | ||
367892 | 9441 | 1 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
CHEMBL112222 | 9441 | 1 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
44287094 | 99837 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 824 | 20 | 6 | 7 | 5.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL289209 | 99837 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 824 | 20 | 6 | 7 | 5.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
15689734 | 106127 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||
CHEMBL3142899 | 106127 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||
54584255 | 61588 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774036 | 61588 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
14208275 | 67405 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907849 | 67405 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208226 | 77475 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092871 | 77475 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10011017 | 108245 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 916 | 22 | 8 | 7 | 5.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL320854 | 108245 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 916 | 22 | 8 | 7 | 5.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
367892 | 9441 | 1 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL112222 | 9441 | 1 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
14991579 | 100521 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 862 | 21 | 9 | 8 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL294304 | 100521 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 862 | 21 | 9 | 8 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14208275 | 67405 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL1907849 | 67405 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 443 | 3 | 1 | 3 | 4.7 | CN1C(=O)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
155531277 | 171065 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1821 | 72 | 18 | 23 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4465747 | 171065 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1821 | 72 | 18 | 23 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
52944224 | 17951 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 586 | 8 | 2 | 7 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269259 | 17951 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 586 | 8 | 2 | 7 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
10478703 | 119407 | 1 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)NC2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL349291 | 119407 | 1 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)NC2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
14208271 | 102422 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL305951 | 102422 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
14208214 | 164696 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc2ccccc2c1 | 10.1021/jm00047a021 | ||
CHEMBL422951 | 164696 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc2ccccc2c1 | 10.1021/jm00047a021 | ||
44306744 | 102193 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 782 | 20 | 9 | 7 | 2.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL304524 | 102193 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 782 | 20 | 9 | 7 | 2.5 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL1172253 | 206843 | 0 | None | -138 | 4 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
CHEMBL319438 | 209471 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00017a022 | ||||
44304324 | 199019 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(97)00353-3 | ||
CHEMBL59993 | 199019 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(97)00353-3 | ||
444998 | 207574 | 26 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
CHEMBL216166 | 207574 | 26 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
44382563 | 120239 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 742 | 15 | 5 | 7 | 5.3 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccc(OS(=O)(=O)O)cc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL355052 | 120239 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 742 | 15 | 5 | 7 | 5.3 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccc(OS(=O)(=O)O)cc1 | 10.1016/S0960-894X(00)80687-3 | ||
15104599 | 9920 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
CHEMBL114980 | 9920 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
11757086 | 25472 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 541 | 10 | 2 | 6 | 4.2 | CCN(CC)CC(=O)OCCN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135218 | 25472 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 541 | 10 | 2 | 6 | 4.2 | CCN(CC)CC(=O)OCCN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44578456 | 189005 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5cnccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL514716 | 189005 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5cnccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
44279811 | 96477 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 743 | 15 | 4 | 7 | 5.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL265987 | 96477 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 743 | 15 | 4 | 7 | 5.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44280028 | 98720 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 768 | 17 | 6 | 9 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL281318 | 98720 | 0 | None | - | 1 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 768 | 17 | 6 | 9 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44333341 | 107300 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 448 | 4 | 2 | 5 | 2.9 | CCCN1C(=O)[C@@H](NC(=O)Nc2cccc(C)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL319180 | 107300 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 448 | 4 | 2 | 5 | 2.9 | CCCN1C(=O)[C@@H](NC(=O)Nc2cccc(C)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
13809514 | 202404 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 412 | 5 | 2 | 4 | 2.5 | CN1C(=O)[C@@H](NC(=O)[C@H](N)Cc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL70259 | 202404 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 412 | 5 | 2 | 4 | 2.5 | CN1C(=O)[C@@H](NC(=O)[C@H](N)Cc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
121964 | 205 | 28 | None | - | 2 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
858 | 205 | 28 | None | - | 2 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
CHEMBL323521 | 205 | 28 | None | - | 2 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00100a033 | ||||
44334345 | 163302 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 504 | 8 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)N[C@H](CCC(=O)N2CCCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL420658 | 163302 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 504 | 8 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)N[C@H](CCC(=O)N2CCCC2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
367893 | 51344 | 1 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
CHEMBL158362 | 51344 | 1 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
44408526 | 136422 | 0 | None | -2344 | 4 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1148 | 30 | 11 | 15 | 3.0 | CCCC[C@@H](C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O)N(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
CHEMBL374325 | 136422 | 0 | None | -2344 | 4 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1148 | 30 | 11 | 15 | 3.0 | CCCC[C@@H](C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O)N(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
16100409 | 82821 | 0 | None | -870 | 3 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL218651 | 82821 | 0 | None | -870 | 3 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
44303251 | 101764 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 618 | 12 | 5 | 5 | 4.6 | O=C(O)CCC(=O)N[C@@H](CNC(=O)C(Cc1c[nH]c2ccc(F)cc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL303020 | 101764 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 618 | 12 | 5 | 5 | 4.6 | O=C(O)CCC(=O)N[C@@H](CNC(=O)C(Cc1c[nH]c2ccc(F)cc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
44349325 | 167983 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 465 | 7 | 3 | 4 | 3.1 | O=C(O)CCC(NC(=O)c1cccc(Br)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL435587 | 167983 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 465 | 7 | 3 | 4 | 3.1 | O=C(O)CCC(NC(=O)c1cccc(Br)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
9827037 | 78419 | 6 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H]1CCCC[C@@H]1O | 10.1021/jm970065l | ||
CHEMBL2112795 | 78419 | 6 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H]1CCCC[C@@H]1O | 10.1021/jm970065l | ||
CHEMBL379405 | 210518 | 0 | None | -11 | 4 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
1614 | 2317 | 60 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 10.1021/jm051050n | ||
60182 | 2317 | 60 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 10.1021/jm051050n | ||
892 | 2317 | 60 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 10.1021/jm051050n | ||
CHEMBL206025 | 2317 | 60 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 10.1021/jm051050n | ||
44368368 | 120564 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 481 | 8 | 3 | 3 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL357027 | 120564 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 481 | 8 | 3 | 3 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
10071178 | 74146 | 1 | None | 501 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm051050n | ||
CHEMBL202861 | 74146 | 1 | None | 501 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm051050n | ||
136060576 | 87064 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 571 | 5 | 1 | 5 | 8.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(-c4ccccc4)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL233457 | 87064 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 571 | 5 | 1 | 5 | 8.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(-c4ccccc4)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
10071178 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL202861 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10071178 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL202861 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
10071178 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL202861 | 74146 | 1 | None | - | 2 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
44283081 | 99409 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL2112071 | 99409 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL285880 | 99409 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
44327456 | 206107 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 585 | 11 | 2 | 5 | 5.7 | COC(=O)CCN(CCc1ccccc1)C(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL96401 | 206107 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 585 | 11 | 2 | 5 | 5.7 | COC(=O)CCN(CCc1ccccc1)C(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
44303652 | 199006 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 570 | 8 | 2 | 3 | 7.2 | CC(Cc1ccc2c(c1)C(C)(C)CCC2(C)C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL59985 | 199006 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 570 | 8 | 2 | 3 | 7.2 | CC(Cc1ccc2c(c1)C(C)(C)CCC2(C)C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
10530400 | 118830 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 535 | 7 | 3 | 5 | 5.0 | COC(=O)C1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)CCCCC1 | 10.1021/jm970065l | ||
CHEMBL344220 | 118830 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 535 | 7 | 3 | 5 | 5.0 | COC(=O)C1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)CCCCC1 | 10.1021/jm970065l | ||
14208235 | 102665 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 442 | 4 | 3 | 4 | 3.9 | COc1ccc2[nH]c(C(=O)NC3N=C(c4ccccc4F)c4ccccc4NC3=O)cc2c1 | 10.1021/jm00047a021 | ||
CHEMBL307878 | 102665 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 442 | 4 | 3 | 4 | 3.9 | COc1ccc2[nH]c(C(=O)NC3N=C(c4ccccc4F)c4ccccc4NC3=O)cc2c1 | 10.1021/jm00047a021 | ||
10746778 | 47296 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 646 | 8 | 2 | 6 | 5.2 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(N2CCOCC2)cc1 | 10.1021/jm950626d | ||
CHEMBL154615 | 47296 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 646 | 8 | 2 | 6 | 5.2 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(N2CCOCC2)cc1 | 10.1021/jm950626d | ||
14208201 | 202875 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 436 | 6 | 3 | 3 | 4.4 | O=C(CCCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL73110 | 202875 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 436 | 6 | 3 | 3 | 4.4 | O=C(CCCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
52942901 | 17953 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269261 | 17953 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
54583298 | 61594 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774042 | 61594 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
10079035 | 163309 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 796 | 21 | 8 | 7 | 2.9 | CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL420667 | 163309 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 796 | 21 | 8 | 7 | 2.9 | CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00164a020 | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00164a020 | ||
10476766 | 102526 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 3 | 3 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL306806 | 102526 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 3 | 3 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00047a021 | ||
15667016 | 85691 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 960 | 25 | 9 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL2310856 | 85691 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 960 | 25 | 9 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
10476766 | 102526 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 3 | 3 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL306806 | 102526 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 412 | 3 | 3 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
10008654 | 127094 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL366344 | 127094 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 595 | 6 | 3 | 5 | 5.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc4ccccc34)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44348650 | 112607 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 986 | 24 | 11 | 11 | 2.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL331408 | 112607 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 986 | 24 | 11 | 11 | 2.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
10011110 | 160782 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 948 | 24 | 8 | 7 | 5.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL412544 | 160782 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 948 | 24 | 8 | 7 | 5.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
44329343 | 111838 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 556 | 7 | 3 | 4 | 5.6 | COc1ccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL329286 | 111838 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 556 | 7 | 3 | 4 | 5.6 | COc1ccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
155546692 | 173070 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1861 | 72 | 19 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4534236 | 173070 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 1861 | 72 | 19 | 23 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10454890 | 154603 | 1 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL40211 | 154603 | 1 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
10454890 | 154603 | 1 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL40211 | 154603 | 1 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL106722 | 206730 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
24784941 | 189126 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 516 | 6 | 0 | 5 | 6.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515616 | 189126 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 516 | 6 | 0 | 5 | 6.4 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL263155 | 208815 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
54587150 | 61535 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773887 | 61535 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
54580266 | 61536 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773888 | 61536 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
14208241 | 67409 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907852 | 67409 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
24784940 | 182205 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479046 | 182205 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
14208269 | 77473 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL2092869 | 77473 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL2079549 | 207448 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(CC(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
155551968 | 173445 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1793 | 69 | 16 | 20 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4542927 | 173445 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1793 | 69 | 16 | 20 | 4.5 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44348901 | 141296 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1000 | 24 | 11 | 11 | 2.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)c1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL386376 | 141296 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 1000 | 24 | 11 | 11 | 2.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)c1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
44344743 | 163021 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 555 | 11 | 4 | 3 | 5.3 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)CC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm000937a | ||
CHEMBL420320 | 163021 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 555 | 11 | 4 | 3 | 5.3 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)CC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm000937a | ||
904 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
9915756 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL2111204 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL356898 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
904 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
9915756 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL2111204 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL356898 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
44329486 | 112102 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3ccc(F)cc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL330197 | 112102 | 0 | None | - | 0 | Guinea pig | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3ccc(F)cc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
904 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
9915756 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL2111204 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL356898 | 2977 | 7 | None | - | 1 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44398261 | 123867 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
11103804 | 114955 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=S)C[C@@H]12 | 10.1021/jm010898i | ||
CHEMBL3350855 | 114955 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=S)C[C@@H]12 | 10.1021/jm010898i | ||
14208241 | 67409 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL1907852 | 67409 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
10320031 | 77472 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL2092868 | 77472 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
14208269 | 77473 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092869 | 77473 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
10973734 | 78025 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
CHEMBL2111549 | 78025 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
14991570 | 201127 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 943 | 22 | 9 | 11 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2cc(OS(=O)(=O)O)ccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL62345 | 201127 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 943 | 22 | 9 | 11 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2cc(OS(=O)(=O)O)ccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44382008 | 58741 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL169438 | 58741 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
13503154 | 99803 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 363 | 9 | 4 | 6 | 0.1 | CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||
CHEMBL288892 | 99803 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 363 | 9 | 4 | 6 | 0.1 | CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||
72707158 | 140221 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 265 | 3 | 1 | 2 | 2.5 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3818215 | 140221 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 265 | 3 | 1 | 2 | 2.5 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
14208271 | 102422 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL305951 | 102422 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 455 | 3 | 1 | 3 | 4.4 | CN1C(=O)C(NC(=O)c2ccc(C(F)(F)F)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208214 | 164696 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc2ccccc2c1 | 10.1021/jm00120a002 | ||
CHEMBL422951 | 164696 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 405 | 3 | 2 | 3 | 4.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc2ccccc2c1 | 10.1021/jm00120a002 | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
14208249 | 202926 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 3 | 2 | 3 | 3.7 | Cc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL73510 | 202926 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 3 | 2 | 3 | 3.7 | Cc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
10603714 | 155977 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4c(F)cccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL406790 | 155977 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4c(F)cccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
367893 | 51344 | 1 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
CHEMBL158362 | 51344 | 1 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00124a003 | ||
13953692 | 101251 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 407 | 3 | 1 | 4 | 5.0 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nncn2-c2ccccc21 | 10.1021/jm00396a028 | ||
CHEMBL299538 | 101251 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 407 | 3 | 1 | 4 | 5.0 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nncn2-c2ccccc21 | 10.1021/jm00396a028 | ||
89913094 | 140250 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 251 | 2 | 1 | 2 | 2.2 | CC(C)N1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3818578 | 140250 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 251 | 2 | 1 | 2 | 2.2 | CC(C)N1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
14208235 | 102665 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 442 | 4 | 3 | 4 | 3.9 | COc1ccc2[nH]c(C(=O)NC3N=C(c4ccccc4F)c4ccccc4NC3=O)cc2c1 | 10.1021/jm00120a002 | ||
CHEMBL307878 | 102665 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 442 | 4 | 3 | 4 | 3.9 | COc1ccc2[nH]c(C(=O)NC3N=C(c4ccccc4F)c4ccccc4NC3=O)cc2c1 | 10.1021/jm00120a002 | ||
11798691 | 57963 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 473 | 5 | 4 | 7 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Nc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL168263 | 57963 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 473 | 5 | 4 | 7 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Nc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm9506736 | ||
10962743 | 78187 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccc(N2C(=O)C[C@@H]3[C@@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
CHEMBL2112239 | 78187 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1ccc(N2C(=O)C[C@@H]3[C@@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
44370505 | 51005 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 543 | 10 | 2 | 4 | 6.3 | O=C(CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1)OCc1ccccc1 | 10.1021/jm00164a020 | ||
CHEMBL158078 | 51005 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 543 | 10 | 2 | 4 | 6.3 | O=C(CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1)OCc1ccccc1 | 10.1021/jm00164a020 | ||
10029582 | 26958 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 4.5 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136608 | 26958 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 4.5 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44356717 | 116280 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 513 | 5 | 3 | 5 | 4.7 | CN1C(=O)C(NC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL337722 | 116280 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 513 | 5 | 3 | 5 | 4.7 | CN1C(=O)C(NC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44578531 | 171994 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 570 | 6 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OCC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL448597 | 171994 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 570 | 6 | 0 | 5 | 6.9 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OCC(F)(F)F)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
44334332 | 108399 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 574 | 10 | 3 | 4 | 5.6 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(Cc2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL321072 | 108399 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 574 | 10 | 3 | 4 | 5.6 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(Cc2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
44349028 | 116719 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 437 | 7 | 3 | 4 | 3.5 | O=C(O)CCC(NC(=O)c1ccc2ccccc2c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL339453 | 116719 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 437 | 7 | 3 | 4 | 3.5 | O=C(O)CCC(NC(=O)c1ccc2ccccc2c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
89913112 | 140271 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 257 | 1 | 1 | 2 | 2.1 | CN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
CHEMBL3818822 | 140271 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 257 | 1 | 1 | 2 | 2.1 | CN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
44280215 | 99369 | 0 | None | - | 1 | Mouse | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 756 | 15 | 6 | 10 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL285586 | 99369 | 0 | None | - | 1 | Mouse | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 756 | 15 | 6 | 10 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44334379 | 108286 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 7 | 2 | 3 | 4.7 | Cc1cccc(NC(=O)N[C@H](CC(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL320901 | 108286 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 435 | 7 | 2 | 3 | 4.7 | Cc1cccc(NC(=O)N[C@H](CC(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
19766161 | 58871 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 403 | 4 | 3 | 3 | 3.4 | O=C(O)CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL170068 | 58871 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 403 | 4 | 3 | 3 | 3.4 | O=C(O)CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
14208201 | 202875 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 436 | 6 | 3 | 3 | 4.4 | O=C(CCCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL73110 | 202875 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 436 | 6 | 3 | 3 | 4.4 | O=C(CCCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
44356972 | 27449 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 555 | 7 | 3 | 7 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)ON3CCC[C@@H]3C(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL136990 | 27449 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 555 | 7 | 3 | 7 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)ON3CCC[C@@H]3C(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
52945789 | 18100 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 541 | 7 | 0 | 5 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1270487 | 18100 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 541 | 7 | 0 | 5 | 6.0 | CC(C)N(C(=O)CN1C(=O)C(Cc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
2802894 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
3509 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
CHEMBL333081 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
2802894 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
3509 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL333081 | 2371 | 30 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@H]([C@@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
45482487 | 196924 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)[nH]c2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL578652 | 196924 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)[nH]c2ccccc12 | 10.1016/j.bmc.2009.05.067 | ||
10768071 | 9741 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 4.3 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL113988 | 9741 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 512 | 6 | 3 | 5 | 4.3 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
44591977 | 178481 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 443 | 7 | 5 | 4 | 3.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccc(O)cc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL471464 | 178481 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 443 | 7 | 5 | 4 | 3.6 | O=C(Nc1ccccc1C(=O)NC(Cc1ccc(O)cc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
44349336 | 163962 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1Cl)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL421474 | 163962 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1Cl)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
10813333 | 104874 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 447 | 5 | 2 | 4 | 4.2 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCCCN2C)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL311638 | 104874 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 447 | 5 | 2 | 4 | 4.2 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCCCN2C)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL3142682 | 209381 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NC1CCCCC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
52940616 | 17955 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269263 | 17955 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
14208249 | 202926 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 3 | 2 | 3 | 3.7 | Cc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL73510 | 202926 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 3 | 2 | 3 | 3.7 | Cc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
9914964 | 9540 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 530 | 13 | 4 | 5 | 5.7 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(O)c2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
CHEMBL112682 | 9540 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 530 | 13 | 4 | 5 | 5.7 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(O)c2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
44293892 | 161138 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 5.8 | CSc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL413267 | 161138 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 613 | 6 | 2 | 5 | 5.8 | CSc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
14888709 | 76897 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1031 | 30 | 11 | 12 | 0.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(CC(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079603 | 76897 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 1031 | 30 | 11 | 12 | 0.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(CC(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
71449099 | 78404 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 414 | 4 | 3 | 4 | 3.0 | CN1C(=O)[C@H](NC(=O)NCc2cccc(O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2112751 | 78404 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 414 | 4 | 3 | 4 | 3.0 | CN1C(=O)[C@H](NC(=O)NCc2cccc(O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991578 | 161166 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 824 | 21 | 8 | 9 | 2.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL413548 | 161166 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 824 | 21 | 8 | 9 | 2.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1cccnc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14208203 | 113964 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 425 | 3 | 2 | 3 | 4.3 | CC1C(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)=Cc2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL333459 | 113964 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 425 | 3 | 2 | 3 | 4.3 | CC1C(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)=Cc2ccccc21 | 10.1021/jm00047a021 | ||
14888706 | 76898 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1017 | 29 | 11 | 12 | 0.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(C(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079604 | 76898 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1017 | 29 | 11 | 12 | 0.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(C(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
10455302 | 27790 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccc([N+](=O)[O-])cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137240 | 27790 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccc([N+](=O)[O-])cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
19766170 | 58845 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 383 | 5 | 3 | 4 | 2.2 | COc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)O)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL169931 | 58845 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 383 | 5 | 3 | 4 | 2.2 | COc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)O)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL2370879 | 208196 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a068 | ||||
44356697 | 25418 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 456 | 5 | 2 | 5 | 3.4 | COC(=O)Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL135166 | 25418 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 456 | 5 | 2 | 5 | 3.4 | COC(=O)Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
9870046 | 26143 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 486 | 5 | 3 | 6 | 3.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(Cc2nn[nH]n2)C1=O | 10.1021/jm00078a018 | ||
CHEMBL135901 | 26143 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 486 | 5 | 3 | 6 | 3.4 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(Cc2nn[nH]n2)C1=O | 10.1021/jm00078a018 | ||
10005779 | 116164 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 489 | 6 | 3 | 4 | 3.8 | CCNC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL337065 | 116164 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 489 | 6 | 3 | 4 | 3.8 | CCNC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44280214 | 106818 | 0 | None | - | 1 | Mouse | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 770 | 16 | 6 | 10 | 3.6 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL31726 | 106818 | 0 | None | - | 1 | Mouse | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 770 | 16 | 6 | 10 | 3.6 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL292097 | 209140 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(01)81005-2 | ||||
5279366 | 103684 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 401 | 4 | 2 | 4 | 4.0 | CSc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL309575 | 103684 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 401 | 4 | 2 | 4 | 4.0 | CSc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
155564367 | 174584 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1836 | 72 | 18 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4570130 | 174584 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 1836 | 72 | 18 | 23 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44303527 | 96042 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 632 | 12 | 5 | 5 | 5.0 | CC(Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL262456 | 96042 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 632 | 12 | 5 | 5 | 5.0 | CC(Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
136794946 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
15689731 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142903 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
136794946 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
15689731 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
CHEMBL3142903 | 106130 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
3960 | 2313 | 20 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1016/S0960-894X(00)80224-3 | ||
891 | 2313 | 20 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1016/S0960-894X(00)80224-3 | ||
44311642 | 202448 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 425 | 3 | 2 | 3 | 4.0 | CC1(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)C=Cc2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL70549 | 202448 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 425 | 3 | 2 | 3 | 4.0 | CC1(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)C=Cc2ccccc21 | 10.1021/jm00120a002 | ||
24784942 | 180761 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 488 | 4 | 1 | 5 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(O)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476297 | 180761 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 488 | 4 | 1 | 5 | 5.7 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(O)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
90663975 | 106315 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1cccc(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144537 | 106315 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 839 | 21 | 9 | 9 | 3.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1cccc(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44303224 | 141403 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 933 | 23 | 8 | 11 | 2.8 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL387073 | 141403 | 0 | None | - | 0 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 933 | 23 | 8 | 11 | 2.8 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44348637 | 163958 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 966 | 27 | 11 | 11 | 1.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL421471 | 163958 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 966 | 27 | 11 | 11 | 1.0 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10507071 | 113111 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
CHEMBL332261 | 113111 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
44396744 | 123528 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 516 | 7 | 2 | 5 | 4.4 | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
CHEMBL363106 | 123528 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 516 | 7 | 2 | 5 | 4.4 | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
10626665 | 10164 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010898i | ||
CHEMBL116127 | 10164 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010898i | ||
10626665 | 10164 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
CHEMBL116127 | 10164 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
5311148 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm960249k | ||
865 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm960249k | ||
CHEMBL293226 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm960249k | ||
5311148 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm970265x | ||
865 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm970265x | ||
CHEMBL293226 | 1865 | 5 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1ccc(cc1)N(C(=O)CN1C(=O)C(Cc2[nH]nc3c2cccc3)C(=O)N(c2c1cccc2)c1ccccc1)C(C)C | 10.1021/jm970265x | ||
44300891 | 197873 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 586 | 7 | 4 | 6 | 5.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2CC1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL59234 | 197873 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 586 | 7 | 4 | 6 | 5.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2CC1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL3142698 | 209388 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | Cc1ccccc1/N=C(/S)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
10075014 | 162431 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 6 | 2 | 5 | 4.4 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL417521 | 162431 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 6 | 2 | 5 | 4.4 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00121a004 | ||
13822924 | 101474 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.2 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)OCc1ccccc1 | 10.1021/jm00396a028 | ||
CHEMBL301172 | 101474 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 4 | 1 | 6 | 4.2 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)OCc1ccccc1 | 10.1021/jm00396a028 | ||
5279366 | 103684 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 401 | 4 | 2 | 4 | 4.0 | CSc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL309575 | 103684 | 1 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 401 | 4 | 2 | 4 | 4.0 | CSc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
10078285 | 120993 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL358334 | 120993 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
10075014 | 162431 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 6 | 2 | 5 | 4.4 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL417521 | 162431 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 6 | 2 | 5 | 4.4 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00078a018 | ||
90663983 | 106330 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144552 | 106330 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
3960 | 2313 | 20 | None | - | 1 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
891 | 2313 | 20 | None | - | 1 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00164a020 | ||
19766234 | 32120 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 427 | 4 | 1 | 3 | 5.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNc1cccc(C(F)(F)F)c1 | 10.1021/jm00163a069 | ||
CHEMBL141051 | 32120 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 427 | 4 | 1 | 3 | 5.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNc1cccc(C(F)(F)F)c1 | 10.1021/jm00163a069 | ||
10319892 | 58782 | 2 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL169661 | 58782 | 2 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44334250 | 4528 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 514 | 9 | 3 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCCC(C(=O)Nc3ccccc3)C2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL102703 | 4528 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 514 | 9 | 3 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCCC(C(=O)Nc3ccccc3)C2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44334434 | 5022 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 483 | 8 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N[C@H](CCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105527 | 5022 | 0 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 483 | 8 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N[C@H](CCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
13953696 | 101492 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 483 | 4 | 1 | 4 | 6.7 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1021/jm00396a028 | ||
CHEMBL301331 | 101492 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 483 | 4 | 1 | 4 | 6.7 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1021/jm00396a028 | ||
15104615 | 172180 | 0 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 545 | 13 | 2 | 4 | 6.1 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
CHEMBL450883 | 172180 | 0 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 545 | 13 | 2 | 4 | 6.1 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)S(=O)(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
15614749 | 32029 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 393 | 4 | 2 | 4 | 3.5 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccsc1 | 10.1021/jm00163a069 | ||
CHEMBL140984 | 32029 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 393 | 4 | 2 | 4 | 3.5 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccsc1 | 10.1021/jm00163a069 | ||
20063245 | 114843 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 417 | 5 | 2 | 4 | 3.9 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)OCc1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL334933 | 114843 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 417 | 5 | 2 | 4 | 3.9 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)OCc1ccccc1 | 10.1021/jm00163a069 | ||
44349011 | 116360 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 373 | 8 | 4 | 3 | 2.7 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00079a003 | ||
CHEMBL338134 | 116360 | 0 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 373 | 8 | 4 | 3 | 2.7 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00079a003 | ||
10555387 | 29880 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 589 | 10 | 3 | 3 | 7.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(Cc1ccccc1)Cc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL138952 | 29880 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 589 | 10 | 3 | 3 | 7.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC(Cc1ccccc1)Cc1ccccc1 | 10.1021/jm970065l | ||
10720107 | 204956 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 497 | 6 | 3 | 6 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(F)(F)F)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL8954 | 204956 | 0 | None | - | 0 | Rat | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 497 | 6 | 3 | 6 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(F)(F)F)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
44361556 | 116221 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 571 | 4 | 2 | 5 | 4.3 | CC(C)(C)OC(=O)N1Cc2[nH]c3ccccc3c2CC1C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
CHEMBL337362 | 116221 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 571 | 4 | 2 | 5 | 4.3 | CC(C)(C)OC(=O)N1Cc2[nH]c3ccccc3c2CC1C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
10032956 | 167473 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
CHEMBL432258 | 167473 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@H](CNC(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)NC(=O)CCC(=O)O | 10.1021/jm00017a022 | ||
15689730 | 106114 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 854 | 21 | 9 | 8 | 4.4 | CC(C)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142694 | 106114 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 854 | 21 | 9 | 8 | 4.4 | CC(C)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL100609 | 206710 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | COc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
CHEMBL100609 | 206710 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | COc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||||
CHEMBL100609 | 206710 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | COc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
15667017 | 206435 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 974 | 28 | 10 | 11 | 1.7 | CCCC[C@H](NC(=O)/C=C/c1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL98332 | 206435 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 974 | 28 | 10 | 11 | 1.7 | CCCC[C@H](NC(=O)/C=C/c1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
15104594 | 10028 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL115656 | 10028 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL2370119 | 208040 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)C(Cc1cccc(CC(=O)O)c1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL3142687 | 209384 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00092a007 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00092a007 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00105a062 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00105a062 | ||
44382244 | 58883 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 618 | 11 | 4 | 4 | 6.4 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)Nc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL170129 | 58883 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 618 | 11 | 4 | 4 | 6.4 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)Nc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
367893 | 51344 | 1 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL158362 | 51344 | 1 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00057a005 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00057a005 | ||
9828961 | 167423 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 548 | 6 | 4 | 4 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL431919 | 167423 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 548 | 6 | 4 | 4 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
10046475 | 115008 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3cccnc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL335241 | 115008 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3cccnc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
44349087 | 117945 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 7 | 3 | 3 | 3.8 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCC2CCCCC2C1 | 10.1021/jm00079a003 | ||
CHEMBL341143 | 117945 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 420 | 7 | 3 | 3 | 3.8 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCC2CCCCC2C1 | 10.1021/jm00079a003 | ||
15167776 | 67374 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 441 | 5 | 2 | 3 | 4.2 | O=C(O)CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907728 | 67374 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 441 | 5 | 2 | 3 | 4.2 | O=C(O)CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
15282007 | 167745 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 5 | 3 | 5 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3c[nH]cn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL434126 | 167745 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 472 | 5 | 3 | 5 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3c[nH]cn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10838217 | 205603 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 473 | 7 | 3 | 8 | 3.7 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9354 | 205603 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 473 | 7 | 3 | 8 | 3.7 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC)c2)c1 | 10.1021/jm970373j | ||
44327420 | 111097 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 571 | 10 | 2 | 5 | 5.3 | COC(=O)CN(CCc1ccccc1)C(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL328213 | 111097 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 571 | 10 | 2 | 5 | 5.3 | COC(=O)CN(CCc1ccccc1)C(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
10438352 | 9706 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 588 | 8 | 3 | 6 | 3.9 | COC(=O)[C@@]1(Cc2ccccc2)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL113699 | 9706 | 0 | None | - | 1 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 588 | 8 | 3 | 6 | 3.9 | COC(=O)[C@@]1(Cc2ccccc2)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1016/0960-894X(96)00160-6 | ||
44286821 | 167289 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 822 | 18 | 7 | 7 | 5.0 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL430937 | 167289 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 822 | 18 | 7 | 7 | 5.0 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
15104608 | 108340 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL320976 | 108340 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00116a002 | ||
14208260 | 101649 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.3 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00047a021 | ||
CHEMBL302359 | 101649 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.3 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00047a021 | ||
19754257 | 119871 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 340 | 3 | 3 | 2 | 4.3 | O=C(Cc1c[nH]c2ccccc12)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL353304 | 119871 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 340 | 3 | 3 | 2 | 4.3 | O=C(Cc1c[nH]c2ccccc12)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
52942901 | 17953 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269261 | 17953 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 556 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2ccccc2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
14208260 | 101649 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.3 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
CHEMBL302359 | 101649 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.3 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(C(F)(F)F)cc1 | 10.1021/jm00120a002 | ||
10453004 | 25920 | 6 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 390 | 3 | 2 | 3 | 3.5 | CN1C(=O)C(NC(=O)NC2CCCCC2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135618 | 25920 | 6 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 390 | 3 | 2 | 3 | 3.5 | CN1C(=O)C(NC(=O)NC2CCCCC2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10482726 | 25936 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 551 | 7 | 3 | 4 | 5.0 | O=C(CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21)NCc1ccccc1 | 10.1021/jm00078a018 | ||
CHEMBL135638 | 25936 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 551 | 7 | 3 | 4 | 5.0 | O=C(CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21)NCc1ccccc1 | 10.1021/jm00078a018 | ||
44334704 | 4550 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 499 | 9 | 2 | 4 | 4.8 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL102862 | 4550 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 499 | 9 | 2 | 4 | 4.8 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
10552615 | 29100 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 6 | 3 | 3 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1 | 10.1021/jm970065l | ||
CHEMBL138311 | 29100 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 6 | 3 | 3 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1 | 10.1021/jm970065l | ||
44382805 | 58900 | 0 | None | - | 0 | Mouse | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 536 | 9 | 3 | 5 | 3.4 | CC(C)C[C@H](NC(=O)C(NC(=O)OC(C)(C)C)c1ccccc1)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL170197 | 58900 | 0 | None | - | 0 | Mouse | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 536 | 9 | 3 | 5 | 3.4 | CC(C)C[C@H](NC(=O)C(NC(=O)OC(C)(C)C)c1ccccc1)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||
44359866 | 116038 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 557 | 9 | 3 | 7 | 3.3 | CC(=O)NCSCC(NC(=O)OC(C)(C)C)C(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
CHEMBL336256 | 116038 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 557 | 9 | 3 | 7 | 3.3 | CC(=O)NCSCC(NC(=O)OC(C)(C)C)C(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
10837829 | 98112 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 463 | 6 | 3 | 6 | 5.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(Cl)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL276627 | 98112 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 463 | 6 | 3 | 6 | 5.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(Cl)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
52946667 | 17956 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 580 | 7 | 1 | 5 | 6.3 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@H](c2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269264 | 17956 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 580 | 7 | 1 | 5 | 6.3 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@H](c2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
613843 | 202873 | 28 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 250 | 1 | 0 | 2 | 2.5 | CN1C(=O)CN=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL73096 | 202873 | 28 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 250 | 1 | 0 | 2 | 2.5 | CN1C(=O)CN=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2372077 | 208438 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](CCCCNCc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
70685411 | 73290 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 606 | 6 | 1 | 5 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017824 | 73290 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 606 | 6 | 1 | 5 | 6.8 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1c1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
54581261 | 61534 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773886 | 61534 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 529 | 6 | 0 | 6 | 6.0 | CCOc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
44348922 | 16065 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 992 | 25 | 11 | 11 | 1.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CCC[C@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL122438 | 16065 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 992 | 25 | 11 | 11 | 1.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CCC[C@H]1NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
903 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm000937a | ||
9850711 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm000937a | ||
CHEMBL138534 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm000937a | ||
CHEMBL2111312 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm000937a | ||
904 | 2977 | 7 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
9915756 | 2977 | 7 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL2111204 | 2977 | 7 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL356898 | 2977 | 7 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@H](NC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
903 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
9850711 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL138534 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL2111312 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
903 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
9850711 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL138534 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL2111312 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm00057a005 | ||
903 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm970065l | ||
9850711 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL138534 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL2111312 | 2975 | 6 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1021/jm970065l | ||
11714635 | 72122 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
CHEMBL198902 | 72122 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
44300889 | 100294 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 6 | 4 | 6 | 3.8 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2C(C)C | 10.1016/0960-894X(95)00327-P | ||
CHEMBL292856 | 100294 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 532 | 6 | 4 | 6 | 3.8 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2C(C)C | 10.1016/0960-894X(95)00327-P | ||
10507109 | 108740 | 0 | None | - | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL321761 | 108740 | 0 | None | - | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
44381593 | 119966 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 854 | 23 | 9 | 10 | 3.3 | CN(C(=O)[C@H](CC(=O)O)NNC[C@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL354171 | 119966 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 854 | 23 | 9 | 10 | 3.3 | CN(C(=O)[C@H](CC(=O)O)NNC[C@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
14208309 | 67345 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 5.0 | CCCCCc1ccc(C(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL1907664 | 67345 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 5.0 | CCCCCc1ccc(C(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
44370393 | 119139 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 492 | 14 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCCC1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL346784 | 119139 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 492 | 14 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCCC1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
14991541 | 106325 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 843 | 22 | 8 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144546 | 106325 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 843 | 22 | 8 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
10369442 | 108060 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 521 | 7 | 3 | 5 | 3.6 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCCC2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL320154 | 108060 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 521 | 7 | 3 | 5 | 3.6 | Cc1cccc(NC(=O)N[C@H](COC(=O)N2CCCC2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44367000 | 119191 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 494 | 6 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL347329 | 119191 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 494 | 6 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
89913427 | 140193 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 311 | 2 | 1 | 2 | 3.4 | O=C1C=C(Cl)C(O)(c2ccc(Cl)cc2)N1C1CCCC1 | 10.1039/C6MD00052E | ||
CHEMBL3817873 | 140193 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 311 | 2 | 1 | 2 | 3.4 | O=C1C=C(Cl)C(O)(c2ccc(Cl)cc2)N1C1CCCC1 | 10.1039/C6MD00052E | ||
89913617 | 140216 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 223 | 1 | 1 | 2 | 1.4 | CN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3818165 | 140216 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 223 | 1 | 1 | 2 | 1.4 | CN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
71458029 | 78380 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2112692 | 78380 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
15104620 | 110872 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccc(C)cc1 | 10.1021/jm00116a002 | ||
CHEMBL326979 | 110872 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 476 | 13 | 3 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccc(C)cc1 | 10.1021/jm00116a002 | ||
14802537 | 58774 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL169615 | 58774 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
10052234 | 67420 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)N[C@H]1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
CHEMBL1907927 | 67420 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)N[C@H]1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
44280115 | 106743 | 0 | None | - | 0 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 658 | 11 | 3 | 6 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL31671 | 106743 | 0 | None | - | 0 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 658 | 11 | 3 | 6 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44329519 | 107801 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 594 | 6 | 3 | 3 | 6.6 | Cc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C(F)(F)F)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL319748 | 107801 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 594 | 6 | 3 | 3 | 6.6 | Cc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C(F)(F)F)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
44334259 | 4405 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 435 | 8 | 2 | 3 | 4.8 | CCCC[C@@H](NC(=O)Nc1cccc(C)c1)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL101803 | 4405 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 435 | 8 | 2 | 3 | 4.8 | CCCC[C@@H](NC(=O)Nc1cccc(C)c1)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
13953694 | 188779 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 523 | 3 | 1 | 4 | 6.8 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nnc(C(Cl)(Cl)Cl)n2-c2ccccc21 | 10.1021/jm00396a028 | ||
CHEMBL51280 | 188779 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 523 | 3 | 1 | 4 | 6.8 | Fc1ccccc1C1=N[C@H](Cc2c[nH]c3ccccc23)c2nnc(C(Cl)(Cl)Cl)n2-c2ccccc21 | 10.1021/jm00396a028 | ||
44368567 | 168170 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL437039 | 168170 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44365359 | 120775 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 546 | 12 | 3 | 5 | 4.5 | COc1ccc(N(C(=O)CN(C(=O)[C@@H](CCC(=O)O)NC(=O)Nc2ccccc2)c2ccccc2)C(C)C)cc1 | 10.1016/S0960-894X(97)00062-0 | ||
CHEMBL357983 | 120775 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 546 | 12 | 3 | 5 | 4.5 | COc1ccc(N(C(=O)CN(C(=O)[C@@H](CCC(=O)O)NC(=O)Nc2ccccc2)c2ccccc2)C(C)C)cc1 | 10.1016/S0960-894X(97)00062-0 | ||
44283246 | 99500 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 527 | 8 | 2 | 4 | 6.8 | O=C(NC(Cc1c[nH]c2ccccc12)C1CN=C(CCc2ccccc2)S1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL286442 | 99500 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 527 | 8 | 2 | 4 | 6.8 | O=C(NC(Cc1c[nH]c2ccccc12)C1CN=C(CCc2ccccc2)S1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10722372 | 119076 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(C(=O)O)cc1 | 10.1021/jm950626d | ||
CHEMBL346179 | 119076 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(C(=O)O)cc1 | 10.1021/jm950626d | ||
CHEMBL1172251 | 206841 | 0 | None | -229 | 4 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
44327698 | 205740 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 572 | 10 | 2 | 6 | 4.7 | COC(=O)CN(CCc1ccccn1)C(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL94298 | 205740 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 572 | 10 | 2 | 6 | 4.7 | COC(=O)CN(CCc1ccccn1)C(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
44348869 | 16230 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 407 | 7 | 3 | 4 | 2.6 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)C1 | 10.1021/jm00079a003 | ||
CHEMBL123089 | 16230 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 407 | 7 | 3 | 4 | 2.6 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)C1 | 10.1021/jm00079a003 | ||
9850184 | 110382 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 538 | 6 | 2 | 6 | 4.6 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCC3)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL326102 | 110382 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 538 | 6 | 2 | 6 | 4.6 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCC3)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
11154528 | 196259 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 426 | 7 | 3 | 3 | 3.7 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)C1=Cc2ccccc2C1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL573136 | 196259 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 426 | 7 | 3 | 3 | 3.7 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)C1=Cc2ccccc2C1 | 10.1016/j.bmc.2009.05.067 | ||
44349391 | 116549 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 422 | 9 | 3 | 3 | 4.2 | CCC1(CC)CCC(NC(=O)C(CCC(=O)O)NC(=O)c2cccc(Cl)c2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL339115 | 116549 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 422 | 9 | 3 | 3 | 4.2 | CCC1(CC)CCC(NC(=O)C(CCC(=O)O)NC(=O)c2cccc(Cl)c2)CC1 | 10.1021/jm00079a003 | ||
10814373 | 205374 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 474 | 7 | 3 | 8 | 4.2 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc([N+](=O)[O-])c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9203 | 205374 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 474 | 7 | 3 | 8 | 4.2 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc([N+](=O)[O-])c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
11234811 | 196706 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 394 | 7 | 3 | 4 | 3.4 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cccs1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576731 | 196706 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 394 | 7 | 3 | 4 | 3.4 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cccs1 | 10.1016/j.bmc.2009.05.067 | ||
10005159 | 114909 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 475 | 5 | 3 | 4 | 5.4 | CN1C(=O)C(NC(=O)Nc2cccc(Nc3ccccc3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL335017 | 114909 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 475 | 5 | 3 | 4 | 5.4 | CN1C(=O)C(NC(=O)Nc2cccc(Nc3ccccc3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10550527 | 205645 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 429 | 6 | 3 | 6 | 4.2 | CCOc1cccc(-n2c(NNC(=O)Nc3cccc(C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9377 | 205645 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 429 | 6 | 3 | 6 | 4.2 | CCOc1cccc(-n2c(NNC(=O)Nc3cccc(C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
155517868 | 169644 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1893 | 76 | 19 | 24 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4445353 | 169644 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 1893 | 76 | 19 | 24 | 3.2 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10027443 | 116032 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3ncc[nH]3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL336221 | 116032 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 464 | 5 | 3 | 4 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3ncc[nH]3)C2=O)c1 | 10.1021/jm00078a018 | ||
44283246 | 99500 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 527 | 8 | 2 | 4 | 6.8 | O=C(NC(Cc1c[nH]c2ccccc12)C1CN=C(CCc2ccccc2)S1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL286442 | 99500 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 527 | 8 | 2 | 4 | 6.8 | O=C(NC(Cc1c[nH]c2ccccc12)C1CN=C(CCc2ccccc2)S1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
15689733 | 106132 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00113a023 | ||
CHEMBL3142905 | 106132 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm00113a023 | ||
CHEMBL319814 | 209477 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
44373740 | 119387 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 569 | 8 | 3 | 5 | 5.2 | COC(=O)[C@@]1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
CHEMBL349079 | 119387 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 569 | 8 | 3 | 5 | 5.2 | COC(=O)[C@@]1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
10070678 | 120242 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL355092 | 120242 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL319814 | 209477 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
14888736 | 97635 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 974 | 29 | 10 | 11 | 1.2 | CSCC[C@H](NC(=O)CCc1ccc(CC(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL273344 | 97635 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 974 | 29 | 10 | 11 | 1.2 | CSCC[C@H](NC(=O)CCc1ccc(CC(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
10479056 | 25981 | 11 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 5.0 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)c(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135702 | 25981 | 11 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 5.0 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)c(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10070678 | 120242 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL355092 | 120242 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
14519977 | 119444 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00124a003 | ||
CHEMBL349640 | 119444 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00124a003 | ||
44310001 | 202189 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 4.5 | Cc1ccc(C(=O)NC[C@H]2CN=C(c3ccc(F)cc3)c3ccc(C)cc3N2C)cc1 | 10.1021/jm00163a069 | ||
CHEMBL68870 | 202189 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 4.5 | Cc1ccc(C(=O)NC[C@H]2CN=C(c3ccc(F)cc3)c3ccc(C)cc3N2C)cc1 | 10.1021/jm00163a069 | ||
21842325 | 119617 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 2 | 5 | 4.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL351144 | 119617 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 495 | 6 | 2 | 5 | 4.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
135837528 | 119731 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 472 | 5 | 3 | 5 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ncc[nH]3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL352217 | 119731 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 472 | 5 | 3 | 5 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ncc[nH]3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL2372075 | 208436 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
10349938 | 162369 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 722 | 14 | 4 | 6 | 6.7 | CC(Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)OCc1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL417412 | 162369 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 722 | 14 | 4 | 6 | 6.7 | CC(Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)OCc1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
44287086 | 100023 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 782 | 18 | 7 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL290975 | 100023 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 782 | 18 | 7 | 7 | 4.1 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44368382 | 45084 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL152682 | 45084 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10719721 | 205697 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 486 | 7 | 3 | 8 | 3.8 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N(C)C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9406 | 205697 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 486 | 7 | 3 | 8 | 3.8 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N(C)C)c2)c1 | 10.1021/jm970373j | ||
44368567 | 168170 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL437039 | 168170 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL2372076 | 208437 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
14208255 | 202962 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 4 | 2 | 4 | 3.4 | CN(C)c1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL73745 | 202962 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 4 | 2 | 4 | 3.4 | CN(C)c1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44286816 | 160227 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 810 | 20 | 7 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL41142 | 160227 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 810 | 20 | 7 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44286695 | 160419 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 796 | 19 | 7 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL41157 | 160419 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 796 | 19 | 7 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44592082 | 178564 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL472079 | 178564 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
44300551 | 195719 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 390 | 3 | 2 | 3 | 4.1 | Cc1cccc(NC(=O)NC2N=C(C3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
CHEMBL56944 | 195719 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 390 | 3 | 2 | 3 | 4.1 | Cc1cccc(NC(=O)NC2N=C(C3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
15689737 | 106117 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC/N=C(\S)Nc1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142701 | 106117 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 862 | 20 | 9 | 8 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC/N=C(\S)Nc1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL354363 | 209984 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
14208255 | 202962 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 4 | 2 | 4 | 3.4 | CN(C)c1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL73745 | 202962 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 4 | 2 | 4 | 3.4 | CN(C)c1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
443375 | 205872 | 40 | None | - | 5 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00164a020 | ||
CHEMBL9506 | 205872 | 40 | None | - | 5 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00164a020 | ||
9845465 | 118354 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 428 | 5 | 3 | 4 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCO)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL342201 | 118354 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 428 | 5 | 3 | 4 | 3.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCO)C2=O)c1 | 10.1021/jm00078a018 | ||
44303664 | 100242 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 661 | 16 | 7 | 7 | 0.3 | CCCC1C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CN)C1 | 10.1016/S0960-894X(01)81005-2 | ||
CHEMBL292493 | 100242 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 661 | 16 | 7 | 7 | 0.3 | CCCC1C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CN)C1 | 10.1016/S0960-894X(01)81005-2 | ||
CHEMBL3143186 | 209393 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CCC[C@@H]1CCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)[C@@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a068 | ||||
73354293 | 106074 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 650 | 12 | 6 | 5 | 4.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCP(=O)(O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL314178 | 106074 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 650 | 12 | 6 | 5 | 4.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCP(=O)(O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
44312041 | 103222 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 498 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL308769 | 103222 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 498 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
44382243 | 59210 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 632 | 12 | 4 | 4 | 6.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL171562 | 59210 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 632 | 12 | 4 | 4 | 6.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
162666759 | 181738 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 846 | 23 | 9 | 9 | 2.9 | CC(C)C[C@@H](/C=C/NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)OC(C)(C)C | 10.1021/acs.jmedchem.0c00530 | ||
CHEMBL4784305 | 181738 | 0 | None | - | 0 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 846 | 23 | 9 | 9 | 2.9 | CC(C)C[C@@H](/C=C/NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)OC(C)(C)C | 10.1021/acs.jmedchem.0c00530 | ||
15673154 | 85568 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 650 | 12 | 6 | 5 | 4.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCP(=O)(O)O)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304155 | 85568 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 650 | 12 | 6 | 5 | 4.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCP(=O)(O)O)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
14208263 | 203009 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 425 | 7 | 2 | 3 | 5.0 | CCCCCc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL74170 | 203009 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 425 | 7 | 2 | 3 | 5.0 | CCCCCc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
14720389 | 164531 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL422701 | 164531 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
44381609 | 128590 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@H](N[C@H](CC(=O)NC(Cc1ccccc1)C(N)=O)C(=O)O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL367057 | 128590 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@H](N[C@H](CC(=O)NC(Cc1ccccc1)C(N)=O)C(=O)O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
44349298 | 16450 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 429 | 8 | 3 | 4 | 3.5 | CC(C)c1ccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)cc1 | 10.1021/jm00079a003 | ||
CHEMBL124155 | 16450 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 429 | 8 | 3 | 4 | 3.5 | CC(C)c1ccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)cc1 | 10.1021/jm00079a003 | ||
44349101 | 16665 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 468 | 7 | 3 | 3 | 5.0 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NC1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL124805 | 16665 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 468 | 7 | 3 | 3 | 5.0 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NC1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
44592485 | 187243 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 379 | 6 | 4 | 3 | 3.3 | CC(C)C(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL496066 | 187243 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 379 | 6 | 4 | 3 | 3.3 | CC(C)C(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
42636922 | 178534 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL471870 | 178534 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCC[C@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
11799462 | 161467 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 497 | 6 | 3 | 6 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(C(F)(F)F)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL415965 | 161467 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 497 | 6 | 3 | 6 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(C(F)(F)F)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
10553146 | 116213 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 491 | 6 | 3 | 3 | 5.7 | CC1CCCCC1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
CHEMBL337310 | 116213 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 491 | 6 | 3 | 3 | 5.7 | CC1CCCCC1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
9821357 | 17097 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 382 | 9 | 3 | 3 | 3.2 | CC(C)(C)CCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL125703 | 17097 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 382 | 9 | 3 | 3 | 3.2 | CC(C)(C)CCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
45482486 | 196627 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1ccc2[nH]c(C(=O)Nc3ccccc3C(=O)NC(Cc3ccccc3)C(=O)O)cc2c1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576020 | 196627 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1ccc2[nH]c(C(=O)Nc3ccccc3C(=O)NC(Cc3ccccc3)C(=O)O)cc2c1 | 10.1016/j.bmc.2009.05.067 | ||
44382371 | 119995 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 436 | 5 | 2 | 4 | 2.8 | COc1cccc(NC(=O)N[C@@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL354442 | 119995 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 436 | 5 | 2 | 4 | 2.8 | COc1cccc(NC(=O)N[C@@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
14208216 | 102230 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 393 | 3 | 1 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccsc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL304768 | 102230 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 393 | 3 | 1 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccsc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
44286378 | 167552 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 3.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1cccnc1)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00037a006 | ||
CHEMBL432864 | 167552 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 3.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1cccnc1)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00037a006 | ||
14991586 | 100172 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 3.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1cccnc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL292071 | 100172 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 3.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1cccnc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
5279119 | 203045 | 1 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00047a021 | ||
CHEMBL74515 | 203045 | 1 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00047a021 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm020424z | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm020424z | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00121a004 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00121a004 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm000937a | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm000937a | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00164a020 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00164a020 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL172135 | 207107 | 0 | None | - | 0 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
44409521 | 139640 | 4 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 351 | 5 | 4 | 3 | 2.6 | CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1021/jm051050n | ||
CHEMBL380355 | 139640 | 4 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 351 | 5 | 4 | 3 | 2.6 | CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1021/jm051050n | ||
70697534 | 77494 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 367 | 3 | 2 | 3 | 4.4 | O=C1Nc2ccccc2C(c2ccccc2)=NC1C[C@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL2092989 | 77494 | 0 | None | - | 0 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 367 | 3 | 2 | 3 | 4.4 | O=C1Nc2ccccc2C(c2ccccc2)=NC1C[C@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
15167797 | 31441 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 403 | 5 | 2 | 4 | 4.4 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)OCc1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL140495 | 31441 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 403 | 5 | 2 | 4 | 4.4 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)OCc1ccccc1 | 10.1021/jm00163a069 | ||
44303233 | 100188 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 632 | 12 | 5 | 5 | 5.0 | C[C@](Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL292194 | 100188 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 632 | 12 | 5 | 5 | 5.0 | C[C@](Cc1c[nH]c2ccc(F)cc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
9985099 | 116775 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2cc(Cl)ccc21 | 10.1021/jm00048a015 | ||
CHEMBL339515 | 116775 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2cc(Cl)ccc21 | 10.1021/jm00048a015 | ||
44592485 | 187243 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 379 | 6 | 4 | 3 | 3.3 | CC(C)C(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL496066 | 187243 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 379 | 6 | 4 | 3 | 3.3 | CC(C)C(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
10255357 | 18332 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
CHEMBL127397 | 18332 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.0 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44368567 | 168170 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL437039 | 168170 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 495 | 9 | 4 | 4 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1F)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44349393 | 16655 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 422 | 7 | 3 | 3 | 4.3 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCCCCC1 | 10.1021/jm00079a003 | ||
CHEMBL124764 | 16655 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 422 | 7 | 3 | 3 | 4.3 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCCCCC1 | 10.1021/jm00079a003 | ||
44381550 | 164681 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 842 | 23 | 11 | 10 | 3.0 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL422919 | 164681 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 842 | 23 | 11 | 10 | 3.0 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
5279119 | 203045 | 1 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00120a002 | ||
CHEMBL74515 | 203045 | 1 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00120a002 | ||
15104606 | 9366 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 497 | 13 | 2 | 2 | 6.9 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL111837 | 9366 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 497 | 13 | 2 | 2 | 6.9 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00116a002 | ||
44309988 | 102195 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 4.5 | Cc1ccc(C(=O)NC[C@@H]2CN=C(c3ccc(F)cc3)c3ccc(C)cc3N2C)cc1 | 10.1021/jm00163a069 | ||
CHEMBL304546 | 102195 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 4 | 1 | 3 | 4.5 | Cc1ccc(C(=O)NC[C@@H]2CN=C(c3ccc(F)cc3)c3ccc(C)cc3N2C)cc1 | 10.1021/jm00163a069 | ||
10698905 | 205145 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4cc(F)ccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL90697 | 205145 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4cc(F)ccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10077842 | 108600 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 637 | 8 | 2 | 5 | 5.8 | CN(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)c3ccccc3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL321321 | 108600 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 637 | 8 | 2 | 5 | 5.8 | CN(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)c3ccccc3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
44458068 | 85335 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL22918 | 85335 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 2.7 | O=C(N[C@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
10047669 | 78108 | 1 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2111924 | 78108 | 1 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991543 | 106323 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 839 | 22 | 8 | 8 | 3.5 | Cc1ccc(CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
CHEMBL3144544 | 106323 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 839 | 22 | 8 | 8 | 3.5 | Cc1ccc(CCC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
44334248 | 4612 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 8 | 3 | 5 | 4.9 | Cc1cccc(NC(=O)N[C@H](COC(=O)Nc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL103312 | 4612 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 528 | 8 | 3 | 5 | 4.9 | Cc1cccc(NC(=O)N[C@H](COC(=O)Nc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
20190195 | 30572 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1ccccc1F | 10.1021/jm00163a069 | ||
CHEMBL139615 | 30572 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 405 | 4 | 1 | 3 | 4.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1ccccc1F | 10.1021/jm00163a069 | ||
44356619 | 118291 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 415 | 4 | 2 | 5 | 3.1 | COc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cn1 | 10.1021/jm00078a018 | ||
CHEMBL342142 | 118291 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 415 | 4 | 2 | 5 | 3.1 | COc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cn1 | 10.1021/jm00078a018 | ||
11799359 | 28838 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H]1CCCC[C@H]1O | 10.1021/jm970065l | ||
CHEMBL138084 | 28838 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 493 | 6 | 4 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H]1CCCC[C@H]1O | 10.1021/jm970065l | ||
54580264 | 61529 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1cccc(-c2ncc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773880 | 61529 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1cccc(-c2ncc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
21842340 | 43840 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 508 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3(C)CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL151483 | 43840 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 508 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3(C)CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
45482489 | 196750 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccc(F)cc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL577161 | 196750 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccc(F)cc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
135703408 | 142304 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 511 | 4 | 2 | 6 | 6.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(O)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL389311 | 142304 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 511 | 4 | 2 | 6 | 6.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(O)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
9936789 | 204863 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 7 | 3 | 8 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(=O)OC(C)(C)C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL8890 | 204863 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 529 | 7 | 3 | 8 | 5.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(=O)OC(C)(C)C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
9887120 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00121a004 | ||
CHEMBL70380 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00121a004 | ||
9887120 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm000937a | ||
CHEMBL70380 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm000937a | ||
14208237 | 202512 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 498 | 6 | 2 | 5 | 3.8 | CCOC(=O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL70883 | 202512 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 498 | 6 | 2 | 5 | 3.8 | CCOC(=O)CN1C(=O)C(NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10079315 | 167305 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 859 | 21 | 9 | 7 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL431065 | 167305 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 859 | 21 | 9 | 7 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL156559 | 207062 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
14888718 | 76899 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1041 | 29 | 11 | 14 | -0.1 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(-c2nn[nH]n2)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079606 | 76899 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1041 | 29 | 11 | 14 | -0.1 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(-c2nn[nH]n2)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
10253366 | 115845 | 11 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 5.0 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL335951 | 115845 | 11 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 5.0 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10094138 | 167767 | 6 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccccc2[N+](=O)[O-])N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL434255 | 167767 | 6 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccccc2[N+](=O)[O-])N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
9887120 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL70380 | 202426 | 3 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(00)80684-8 | ||
155540394 | 172367 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1820 | 69 | 17 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4516794 | 172367 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 1820 | 69 | 17 | 23 | 2.7 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
24785179 | 180954 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 502 | 6 | 0 | 5 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476520 | 180954 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 502 | 6 | 0 | 5 | 6.1 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccccc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
14991585 | 100557 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 919 | 21 | 7 | 10 | 4.3 | CC(=O)Oc1ccc2cc(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc3ccccc3)C(N)=O)ccc2c1 | 10.1021/jm00089a010 | ||
CHEMBL294542 | 100557 | 0 | None | - | 0 | Guinea pig | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 919 | 21 | 7 | 10 | 4.3 | CC(=O)Oc1ccc2cc(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc3ccccc3)C(N)=O)ccc2c1 | 10.1021/jm00089a010 | ||
14208292 | 203014 | 1 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2cccc(Br)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL74228 | 203014 | 1 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2cccc(Br)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
14208293 | 67408 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2cccc(Br)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907851 | 67408 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2cccc(Br)c2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
15689729 | 106115 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 890 | 20 | 9 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1Br)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142695 | 106115 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 890 | 20 | 9 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1Br)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
44386048 | 61188 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)/C(=C/c1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL177081 | 61188 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)/C(=C/c1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL156559 | 207062 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
44381480 | 59143 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 825 | 20 | 7 | 8 | 4.6 | Cc1ccccc1NC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL171227 | 59143 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 825 | 20 | 7 | 8 | 4.6 | Cc1ccccc1NC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL156559 | 207062 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
CHEMBL156559 | 207062 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||||
CHEMBL319340 | 209470 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
CHEMBL320868 | 209483 | 0 | None | - | 2 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
CHEMBL320868 | 209483 | 0 | None | - | 2 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||||
CHEMBL319340 | 209470 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
CHEMBL320868 | 209483 | 0 | None | - | 2 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
44381695 | 120325 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 811 | 20 | 8 | 8 | 4.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL355836 | 120325 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 811 | 20 | 8 | 8 | 4.3 | Cc1ccccc1NC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL320868 | 209483 | 0 | None | - | 2 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
44398261 | 123867 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL363916 | 123867 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 577 | 7 | 4 | 6 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(S)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL319340 | 209470 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80687-3 | ||||
14991584 | 161193 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 877 | 20 | 8 | 9 | 4.1 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)c1ccc2cc(O)ccc2c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL413768 | 161193 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 877 | 20 | 8 | 9 | 4.1 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)c1ccc2cc(O)ccc2c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
71452818 | 79304 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)C(=Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL2115543 | 79304 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)C(=Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL317477 | 209457 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
10074366 | 120087 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
11146119 | 78026 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
CHEMBL2111550 | 78026 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 559 | 6 | 3 | 5 | 4.4 | Cc1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
44382038 | 119954 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)N[C@@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL354040 | 119954 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 420 | 4 | 2 | 3 | 3.1 | Cc1cccc(NC(=O)N[C@@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
903 | 2975 | 6 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80273-5 | ||
9850711 | 2975 | 6 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL138534 | 2975 | 6 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL2111312 | 2975 | 6 | None | - | 1 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1 | 10.1016/S0960-894X(00)80273-5 | ||
178143 | 16673 | 2 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00079a003 | ||
CHEMBL124832 | 16673 | 2 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00079a003 | ||
44381915 | 58747 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 454 | 15 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL169466 | 58747 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 454 | 15 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL2079548 | 207447 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(C(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
24785430 | 181702 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 530 | 6 | 0 | 5 | 6.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(C)C)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478397 | 181702 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 530 | 6 | 0 | 5 | 6.8 | Cc1ccc(-c2nc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)cn2-c2cccc(OC(C)C)c2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
14991581 | 101964 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 855 | 22 | 8 | 9 | 3.2 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)CCc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL303994 | 101964 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 855 | 22 | 8 | 9 | 3.2 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)CCc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
90663985 | 106332 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 853 | 22 | 8 | 9 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
CHEMBL3144554 | 106332 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 853 | 22 | 8 | 9 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
44349268 | 16607 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 399 | 9 | 3 | 4 | 3.1 | CC(C)(C)CCCNC(=O)C(CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00079a003 | ||
CHEMBL124509 | 16607 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 399 | 9 | 3 | 4 | 3.1 | CC(C)(C)CCCNC(=O)C(CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00079a003 | ||
44381482 | 58764 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 827 | 22 | 10 | 9 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@H](CNN[C@@H](Cc1ccccc1)C(N)=O)CC(=O)O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL169567 | 58764 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 827 | 22 | 10 | 9 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@H](CNN[C@@H](Cc1ccccc1)C(N)=O)CC(=O)O | 10.1016/S0960-894X(00)80680-0 | ||
13822916 | 189134 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 421 | 3 | 1 | 4 | 5.3 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00396a028 | ||
CHEMBL51569 | 189134 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 421 | 3 | 1 | 4 | 5.3 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00396a028 | ||
89913710 | 140290 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 285 | 2 | 1 | 2 | 2.9 | CC(C)N1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
CHEMBL3819054 | 140290 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 285 | 2 | 1 | 2 | 2.9 | CC(C)N1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
73349790 | 105695 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 725 | 14 | 5 | 6 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNS(=O)(=O)c1ccccc1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL313756 | 105695 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 725 | 14 | 5 | 6 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNS(=O)(=O)c1ccccc1)c1ccccc1 | 10.1021/jm00092a007 | ||
14208205 | 202517 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 3 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ncc2ccccc2n1 | 10.1021/jm00120a002 | ||
CHEMBL70896 | 202517 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 3 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ncc2ccccc2n1 | 10.1021/jm00120a002 | ||
14208238 | 202432 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 394 | 5 | 3 | 3 | 4.1 | O=C1Nc2ccccc2C(c2ccccc2)=NC1NCCc1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
CHEMBL70405 | 202432 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 394 | 5 | 3 | 3 | 4.1 | O=C1Nc2ccccc2C(c2ccccc2)=NC1NCCc1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
10648445 | 58605 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 6 | 4 | 7 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CNc3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL168903 | 58605 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 6 | 4 | 7 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CNc3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
10695559 | 58728 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 467 | 5 | 4 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Nc3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL169362 | 58728 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 467 | 5 | 4 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Nc3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
10576729 | 58918 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 5 | 4 | 7 | 3.2 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1Nc1nn[nH]n1 | 10.1021/jm9506736 | ||
CHEMBL170275 | 58918 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 5 | 4 | 7 | 3.2 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1Nc1nn[nH]n1 | 10.1021/jm9506736 | ||
10814625 | 83054 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 5 | 3 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(N(C)c3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL22003 | 83054 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 481 | 5 | 3 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(N(C)c3nn[nH]n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
10815094 | 119893 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 495 | 5 | 3 | 7 | 3.2 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1N(C)c1nn[nH]n1 | 10.1021/jm9506736 | ||
CHEMBL353509 | 119893 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 495 | 5 | 3 | 7 | 3.2 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1N(C)c1nn[nH]n1 | 10.1021/jm9506736 | ||
44356620 | 28449 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 400 | 3 | 3 | 5 | 2.6 | CN1C(=O)C(NC(=O)Nc2ccc(N)nc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137748 | 28449 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 400 | 3 | 3 | 5 | 2.6 | CN1C(=O)C(NC(=O)Nc2ccc(N)nc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10765241 | 103503 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 433 | 5 | 3 | 4 | 3.8 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCCCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL309299 | 103503 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 433 | 5 | 3 | 4 | 3.8 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCCCN2)c2ccccc21 | 10.1021/jm9608523 | ||
10717652 | 105677 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 433 | 5 | 3 | 4 | 3.8 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@@H]2CCCCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL313653 | 105677 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 433 | 5 | 3 | 4 | 3.8 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@@H]2CCCCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL44345 | 212174 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||||
15167802 | 67370 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 436 | 5 | 1 | 3 | 5.0 | N#CCCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907720 | 67370 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 436 | 5 | 1 | 3 | 5.0 | N#CCCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
15614820 | 67382 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 437 | 5 | 1 | 2 | 5.5 | O=C1[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc2N1CC1CC1 | 10.1021/jm00390a019 | ||
CHEMBL1907737 | 67382 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 437 | 5 | 1 | 2 | 5.5 | O=C1[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc2N1CC1CC1 | 10.1021/jm00390a019 | ||
15614818 | 67386 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 411 | 4 | 1 | 2 | 5.1 | CCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907742 | 67386 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 411 | 4 | 1 | 2 | 5.1 | CCN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
44370505 | 51005 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 543 | 10 | 2 | 4 | 6.3 | O=C(CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1)OCc1ccccc1 | 10.1021/jm00164a020 | ||
CHEMBL158078 | 51005 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 543 | 10 | 2 | 4 | 6.3 | O=C(CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1)OCc1ccccc1 | 10.1021/jm00164a020 | ||
24039375 | 9794 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 8 | 2 | 6 | 4.9 | CCN(CC)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL114277 | 9794 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 540 | 8 | 2 | 6 | 4.9 | CCN(CC)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
10575687 | 205510 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 453 | 4 | 3 | 5 | 5.2 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2Cl)c1 | 10.1021/jm970373j | ||
CHEMBL9287 | 205510 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 453 | 4 | 3 | 5 | 5.2 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2Cl)c1 | 10.1021/jm970373j | ||
45482483 | 196520 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL575160 | 196520 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
14208205 | 202517 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 3 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ncc2ccccc2n1 | 10.1021/jm00047a021 | ||
CHEMBL70896 | 202517 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 425 | 3 | 2 | 5 | 3.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ncc2ccccc2n1 | 10.1021/jm00047a021 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
9805700 | 118650 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 492 | 6 | 3 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCCCC1 | 10.1021/jm970065l | ||
CHEMBL342932 | 118650 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 492 | 6 | 3 | 4 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCCCC1 | 10.1021/jm970065l | ||
44381319 | 120213 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 495 | 11 | 4 | 5 | 3.6 | N#C[C@H](N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL354817 | 120213 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 495 | 11 | 4 | 5 | 3.6 | N#C[C@H](N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
10556460 | 205012 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 677 | 10 | 0 | 6 | 7.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(Cc4ccccc4)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
CHEMBL89953 | 205012 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 677 | 10 | 0 | 6 | 7.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(Cc4ccccc4)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
10556460 | 205012 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 677 | 10 | 0 | 6 | 7.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(Cc4ccccc4)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL89953 | 205012 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 677 | 10 | 0 | 6 | 7.4 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(Cc4ccccc4)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10344702 | 28418 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 3.6 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCN(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL137714 | 28418 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 471 | 7 | 2 | 5 | 3.6 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCN(C)C)C2=O)c1 | 10.1021/jm00078a018 | ||
10837729 | 105964 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 461 | 5 | 3 | 4 | 4.5 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL313983 | 105964 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 461 | 5 | 3 | 4 | 4.5 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
14519983 | 119471 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL349857 | 119471 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ncccc2c1 | 10.1021/jm00124a003 | ||
44306360 | 157333 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL408395 | 157333 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL1172249 | 206840 | 0 | None | -5 | 4 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1016/j.bmcl.2010.08.115 | ||
44301034 | 101116 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 556 | 6 | 3 | 5 | 4.8 | COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL298627 | 101116 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 556 | 6 | 3 | 5 | 4.8 | COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
44336585 | 110193 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 641 | 7 | 2 | 6 | 5.7 | CN(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C3(C(F)(F)F)N=N3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL325987 | 110193 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 641 | 7 | 2 | 6 | 5.7 | CN(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C3(C(F)(F)F)N=N3)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/s0960-894x(98)00548-4 | ||
10252890 | 25419 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 444 | 5 | 2 | 5 | 3.7 | COc1cc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc(OC)c1 | 10.1021/jm00078a018 | ||
CHEMBL135167 | 25419 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 444 | 5 | 2 | 5 | 3.7 | COc1cc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc(OC)c1 | 10.1021/jm00078a018 | ||
44356868 | 25771 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.3 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1C | 10.1021/jm00078a018 | ||
CHEMBL135433 | 25771 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.3 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1C | 10.1021/jm00078a018 | ||
10071645 | 27785 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 435 | 3 | 2 | 4 | 4.2 | CN1C(=O)C(NC(=O)Nc2ccc3ncccc3c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137238 | 27785 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 435 | 3 | 2 | 4 | 4.2 | CN1C(=O)C(NC(=O)Nc2ccc3ncccc3c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991534 | 106309 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 825 | 22 | 8 | 8 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144531 | 106309 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 825 | 22 | 8 | 8 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14991566 | 167670 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 831 | 22 | 8 | 8 | 3.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCC1CCCCC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL433636 | 167670 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 831 | 22 | 8 | 8 | 3.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCC1CCCCC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44280741 | 156021 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 759 | 15 | 4 | 8 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL406844 | 156021 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 759 | 15 | 4 | 8 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
44312020 | 102732 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 5 | 3 | 4 | 2.5 | N[C@H](Cc1ccccc1)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL308404 | 102732 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 5 | 3 | 4 | 2.5 | N[C@H](Cc1ccccc1)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
71452652 | 78095 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2111884 | 78095 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
14802539 | 76199 | 1 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL2062144 | 76199 | 1 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
44382561 | 167743 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 662 | 13 | 5 | 5 | 5.8 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccc(O)cc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL434113 | 167743 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 662 | 13 | 5 | 5 | 5.8 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCc1ccc(O)cc1 | 10.1016/S0960-894X(00)80687-3 | ||
14802538 | 96241 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL263969 | 96241 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
19756868 | 28205 | 1 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 409 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137520 | 28205 | 1 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 409 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10475990 | 115498 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
CHEMBL33554 | 115498 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
44379627 | 57824 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 4.9 | CC(C)Oc1cccc(-n2c(CNC(=O)NCc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL167758 | 57824 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 4.9 | CC(C)Oc1cccc(-n2c(CNC(=O)NCc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL432671 | 167532 | 0 | None | - | 1 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 784 | 15 | 7 | 12 | 3.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCNC(=O)CC(=O)NCCSCc3csc(C=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
14802538 | 96241 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm970065l | ||
CHEMBL263969 | 96241 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm970065l | ||
53465843 | 69067 | 0 | None | - | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933103 | 69067 | 0 | None | - | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
11178152 | 196670 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 439 | 7 | 3 | 4 | 3.9 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cnc2ccccc2c1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576380 | 196670 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 439 | 7 | 3 | 4 | 3.9 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cnc2ccccc2c1 | 10.1016/j.bmc.2009.05.067 | ||
44349152 | 18375 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 354 | 10 | 3 | 3 | 2.6 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00079a003 | ||
CHEMBL127604 | 18375 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 354 | 10 | 3 | 3 | 2.6 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00079a003 | ||
44381892 | 12170 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 510 | 9 | 2 | 4 | 3.7 | CN(C)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1184772 | 12170 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 510 | 9 | 2 | 4 | 3.7 | CN(C)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL368133 | 12170 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 510 | 9 | 2 | 4 | 3.7 | CN(C)CCNC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL385727 | 210614 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
10049168 | 196199 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL572648 | 196199 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc(F)ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44592009 | 178326 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 397 | 6 | 3 | 2 | 4.8 | CC(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL469974 | 178326 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 397 | 6 | 3 | 2 | 4.8 | CC(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL206974 | 207438 | 0 | None | -72 | 5 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
10744012 | 96930 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 501 | 8 | 3 | 8 | 4.5 | CCOC(=O)c1ccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)cc1 | 10.1021/jm970373j | ||
CHEMBL269662 | 96930 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 501 | 8 | 3 | 8 | 4.5 | CCOC(=O)c1ccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)cc1 | 10.1021/jm970373j | ||
CHEMBL407057 | 210888 | 0 | None | -1513 | 4 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O | 10.1021/jm050921q | ||||
44365304 | 164200 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 444 | 8 | 2 | 3 | 4.3 | CC(C)N(C(=O)CN(C(=O)CNC(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
CHEMBL421778 | 164200 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 444 | 8 | 2 | 3 | 4.3 | CC(C)N(C(=O)CN(C(=O)CNC(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
53465781 | 69063 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 413 | 6 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(C(=O)O)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933099 | 69063 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 413 | 6 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(C(=O)O)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10030027 | 17764 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)[C@@H](c1ccccc1)C[C@@H](NC(=O)Nc1cccc(Cl)c1)C(=O)N2CC(=O)NC(C)(C)C | 10.1021/jm00048a015 | ||
CHEMBL126002 | 17764 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)[C@@H](c1ccccc1)C[C@@H](NC(=O)Nc1cccc(Cl)c1)C(=O)N2CC(=O)NC(C)(C)C | 10.1021/jm00048a015 | ||
CHEMBL2372072 | 208434 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CN)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)N(CCN(CCC(=O)O)CCC(=O)O)CCN(CCC(=O)O)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmc.2007.05.067 | ||||
14208247 | 202945 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 465 | 5 | 2 | 4 | 3.5 | O=C(O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL73621 | 202945 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 465 | 5 | 2 | 4 | 3.5 | O=C(O)CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10323690 | 100032 | 0 | None | - | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL2114401 | 100032 | 0 | None | - | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL291033 | 100032 | 0 | None | - | 2 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00086a017 | ||
10674587 | 78431 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 8 | 3 | 6 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@@H](C#N)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
CHEMBL2112825 | 78431 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 570 | 8 | 3 | 6 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@@H](C#N)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
44301016 | 157433 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 673 | 7 | 4 | 6 | 4.5 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)C(F)(F)F)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL408490 | 157433 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 673 | 7 | 4 | 6 | 4.5 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)C(F)(F)F)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
14519979 | 9439 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00124a003 | ||
CHEMBL112215 | 9439 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00124a003 | ||
10099144 | 114043 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccc(Cl)cc21 | 10.1021/jm00048a015 | ||
CHEMBL333671 | 114043 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccc(Cl)cc21 | 10.1021/jm00048a015 | ||
14519979 | 9439 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00116a002 | ||
CHEMBL112215 | 9439 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cccc2ccccc12 | 10.1021/jm00116a002 | ||
21467078 | 4359 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 448 | 4 | 2 | 5 | 2.9 | CCCN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL101528 | 4359 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 448 | 4 | 2 | 5 | 2.9 | CCCN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
44210428 | 58802 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 485 | 4 | 2 | 4 | 3.1 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3cccc4ccccc34)CCc3ccccc32)CC1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL169794 | 58802 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 485 | 4 | 2 | 4 | 3.1 | CN1CCN(C(=O)CN2C(=O)C(NC(=O)Nc3cccc4ccccc34)CCc3ccccc32)CC1 | 10.1016/S0960-894X(00)80683-6 | ||
14519977 | 119444 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00124a003 | ||
CHEMBL349640 | 119444 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00124a003 | ||
10601173 | 30978 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 491 | 6 | 3 | 3 | 5.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCCC1 | 10.1021/jm970065l | ||
CHEMBL140073 | 30978 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 491 | 6 | 3 | 3 | 5.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCCC1 | 10.1021/jm970065l | ||
10372508 | 98109 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 694 | 13 | 6 | 6 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(01)00630-8 | ||
CHEMBL276613 | 98109 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 694 | 13 | 6 | 6 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(01)00630-8 | ||
44409521 | 139640 | 4 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 351 | 5 | 4 | 3 | 2.6 | CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL380355 | 139640 | 4 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 351 | 5 | 4 | 3 | 2.6 | CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
44349383 | 16588 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 480 | 9 | 3 | 3 | 4.7 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
CHEMBL124396 | 16588 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 480 | 9 | 3 | 3 | 4.7 | O=C(O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
54587149 | 61531 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1cccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773883 | 61531 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 514 | 5 | 0 | 5 | 6.2 | COc1cccc(-c2cnc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
90663982 | 106329 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 855 | 21 | 10 | 10 | 2.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144551 | 106329 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 855 | 21 | 10 | 10 | 2.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14991572 | 162630 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 848 | 20 | 8 | 9 | 3.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cnc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL418123 | 162630 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 848 | 20 | 8 | 9 | 3.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cnc2ccccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
57393204 | 67347 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 3.3 | COc1cccc(CC(=O)N[C@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00120a002 | ||
CHEMBL1907666 | 67347 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 3.3 | COc1cccc(CC(=O)N[C@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00120a002 | ||
44280029 | 95994 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 740 | 15 | 6 | 9 | 3.5 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL262125 | 95994 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 740 | 15 | 6 | 9 | 3.5 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44279810 | 103367 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 757 | 16 | 4 | 7 | 5.7 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30917 | 103367 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 757 | 16 | 4 | 7 | 5.7 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44209154 | 58785 | 1 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 4.2 | O=C(CCc1ccccc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL169675 | 58785 | 1 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 4.2 | O=C(CCc1ccccc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
15167795 | 73730 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 2 | 0 | 3 | 4.6 | CN1C(=O)/C(=C\c2ccsc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL20223 | 73730 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 2 | 0 | 3 | 4.6 | CN1C(=O)/C(=C\c2ccsc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
44349082 | 17593 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 446 | 9 | 3 | 3 | 4.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
CHEMBL125874 | 17593 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 446 | 9 | 3 | 3 | 4.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
44359614 | 31652 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 491 | 8 | 3 | 4 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)CNC1CCCCC1 | 10.1021/jm970065l | ||
CHEMBL140701 | 31652 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 491 | 8 | 3 | 4 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)CNC1CCCCC1 | 10.1021/jm970065l | ||
44382327 | 59045 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 5 | 2 | 4 | 2.8 | COc1cccc(NC(=O)N[C@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL170777 | 59045 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 5 | 2 | 4 | 2.8 | COc1cccc(NC(=O)N[C@H]2CCc3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
44327450 | 167638 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 558 | 10 | 3 | 5 | 4.6 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccn1)CC(=O)O | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL433384 | 167638 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 558 | 10 | 3 | 5 | 4.6 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccn1)CC(=O)O | 10.1016/S0960-894X(01)80769-1 | ||
14208250 | 167487 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL432334 | 167487 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
11327818 | 196427 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 7 | 4 | 4 | 3.2 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1nc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL574488 | 196427 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 7 | 4 | 4 | 3.2 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1nc2ccccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44300890 | 101420 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 580 | 7 | 4 | 6 | 4.3 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2Cc1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL300776 | 101420 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 580 | 7 | 4 | 6 | 4.3 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2Cc1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
15689732 | 106133 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142906 | 106133 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
15689732 | 106133 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
CHEMBL3142906 | 106133 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
44349572 | 114561 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 533 | 5 | 2 | 4 | 6.0 | Cc1ccc2c(c1)N(CC(=O)OC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL334305 | 114561 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 533 | 5 | 2 | 4 | 6.0 | Cc1ccc2c(c1)N(CC(=O)OC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
10455303 | 114721 | 6 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL334592 | 114721 | 6 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 429 | 4 | 2 | 5 | 3.6 | CN1C(=O)C(NC(=O)Nc2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10604135 | 78429 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 637 | 8 | 3 | 5 | 5.1 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm991078x | ||
CHEMBL2112823 | 78429 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 637 | 8 | 3 | 5 | 5.1 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm991078x | ||
70693814 | 73296 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccncc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017830 | 73296 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccncc1 | 10.1016/j.bmcl.2012.02.049 | ||
44311939 | 202790 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 530 | 6 | 2 | 5 | 4.2 | CN1C(=O)C(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL72526 | 202790 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 530 | 6 | 2 | 5 | 4.2 | CN1C(=O)C(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
44396765 | 67038 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 594 | 8 | 2 | 5 | 5.4 | O=C(OC1C2CC3CC(C2)CC1C3)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
CHEMBL188667 | 67038 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 594 | 8 | 2 | 5 | 5.4 | O=C(OC1C2CC3CC(C2)CC1C3)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)CC12 | 10.1021/jm0498755 | ||
10074702 | 27407 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 500 | 8 | 2 | 6 | 4.0 | CCOC(=O)CCN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136966 | 27407 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 500 | 8 | 2 | 6 | 4.0 | CCOC(=O)CCN1C(=O)C(NC(=O)Nc2cccc(OC)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44279809 | 98510 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 785 | 18 | 4 | 7 | 6.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL279778 | 98510 | 0 | None | - | 1 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 785 | 18 | 4 | 7 | 6.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
14208317 | 67348 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907667 | 67348 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccccc2Cl)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208250 | 167487 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL432334 | 167487 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
9865694 | 202475 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 399 | 3 | 2 | 2 | 5.2 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
CHEMBL70728 | 202475 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 399 | 3 | 2 | 2 | 5.2 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00120a002 | ||
44280122 | 99039 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 640 | 10 | 3 | 4 | 5.7 | CN(C(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm950372w | ||
CHEMBL283276 | 99039 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 640 | 10 | 3 | 4 | 5.7 | CN(C(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm950372w | ||
44370497 | 164641 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 453 | 8 | 3 | 3 | 4.6 | O=C(O)CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1 | 10.1021/jm00164a020 | ||
CHEMBL422873 | 164641 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 453 | 8 | 3 | 3 | 4.6 | O=C(O)CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1 | 10.1021/jm00164a020 | ||
44334325 | 167411 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 485 | 9 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(Cc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL431812 | 167411 | 0 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 485 | 9 | 2 | 3 | 5.2 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(Cc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
1043 | 1552 | 13 | None | - | 28 | Mouse | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/S0960-894X(00)80644-7 | ||
149 | 1552 | 13 | None | - | 28 | Mouse | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/S0960-894X(00)80644-7 | ||
8223 | 1552 | 13 | None | - | 28 | Mouse | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/S0960-894X(00)80644-7 | ||
CHEMBL442 | 1552 | 13 | None | - | 28 | Mouse | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/S0960-894X(00)80644-7 | ||
DB00696 | 1552 | 13 | None | - | 28 | Mouse | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 581 | 4 | 3 | 6 | 2.0 | O=C([C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1016/S0960-894X(00)80644-7 | ||
15167794 | 98442 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 2 | 0 | 3 | 4.6 | CN1C(=O)/C(=C/c2ccsc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL279237 | 98442 | 0 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 2 | 0 | 3 | 4.6 | CN1C(=O)/C(=C/c2ccsc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
10649303 | 205723 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 507 | 6 | 3 | 6 | 5.1 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9422 | 205723 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 507 | 6 | 3 | 6 | 5.1 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
10625474 | 29013 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 508 | 8 | 3 | 5 | 4.2 | COC[C@H]1CCCN1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
CHEMBL138233 | 29013 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 508 | 8 | 3 | 5 | 4.2 | COC[C@H]1CCCN1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
44381610 | 119983 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@@H](N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL354359 | 119983 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@@H](N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
10791546 | 205354 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 501 | 8 | 3 | 8 | 4.5 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9188 | 205354 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 501 | 8 | 3 | 8 | 4.5 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
54581260 | 61530 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 5 | 0 | 4 | 6.8 | COc1cccc(-c2ccc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773882 | 61530 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 513 | 5 | 0 | 4 | 6.8 | COc1cccc(-c2ccc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
54586147 | 61533 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773885 | 61533 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1cccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2011.03.069 | ||
54580267 | 61543 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 535 | 5 | 0 | 6 | 6.0 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2Cl)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773895 | 61543 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 535 | 5 | 0 | 6 | 6.0 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2Cl)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
14888738 | 97902 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 984 | 28 | 10 | 13 | 0.8 | CSCC[C@H](NC(=O)CCc1ccc(-c2nn[nH]n2)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL275167 | 97902 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 984 | 28 | 10 | 13 | 0.8 | CSCC[C@H](NC(=O)CCc1ccc(-c2nn[nH]n2)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
44578611 | 189066 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2cccc(F)c2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL515160 | 189066 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 520 | 6 | 0 | 5 | 6.2 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2cccc(F)c2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
19766169 | 165014 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 443 | 4 | 2 | 4 | 4.2 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL424211 | 165014 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 443 | 4 | 2 | 4 | 4.2 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
44336509 | 106869 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL317668 | 106869 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
9980735 | 177871 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 7 | 3 | 4 | 3.9 | Cn1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)cc2ccccc21 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL466135 | 177871 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 7 | 3 | 4 | 3.9 | Cn1c(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)cc2ccccc21 | 10.1016/j.bmc.2009.05.067 | ||
15104626 | 110128 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 448 | 7 | 3 | 3 | 4.4 | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL325662 | 110128 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 448 | 7 | 3 | 3 | 4.4 | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccccc1)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
3081191 | 9457 | 9 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL112307 | 9457 | 9 | None | - | 0 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00124a003 | ||
44272229 | 98291 | 0 | None | - | 1 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80644-7 | ||
CHEMBL278032 | 98291 | 0 | None | - | 1 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80644-7 | ||
44272229 | 98291 | 0 | None | - | 1 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL278032 | 98291 | 0 | None | - | 1 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(01)80253-5 | ||
19754254 | 119844 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 321 | 2 | 2 | 2 | 4.6 | O=C(Nc1cc2c3ccccc3nc-2c[nH]1)c1ccc(Cl)cc1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL353088 | 119844 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 321 | 2 | 2 | 2 | 4.6 | O=C(Nc1cc2c3ccccc3nc-2c[nH]1)c1ccc(Cl)cc1 | 10.1016/S0960-894X(00)80682-4 | ||
44349102 | 167766 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 7 | 3 | 3 | 4.3 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL434250 | 167766 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 434 | 7 | 3 | 3 | 4.3 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
10817407 | 106647 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 601 | 7 | 1 | 6 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc2c(c1)OCO2 | 10.1021/jm970265x | ||
CHEMBL316106 | 106647 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 601 | 7 | 1 | 6 | 5.6 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc2c(c1)OCO2 | 10.1021/jm970265x | ||
10767360 | 204130 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 489 | 5 | 2 | 4 | 5.2 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCC(C)(C)CCN2C)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL83591 | 204130 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 489 | 5 | 2 | 4 | 5.2 | CCCN1C(=O)[C@H](NC(=O)Nc2cccc(C)c2)N=C([C@H]2CCC(C)(C)CCN2C)c2ccccc21 | 10.1021/jm9608523 | ||
44408590 | 161177 | 0 | None | - | 2 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL413644 | 161177 | 0 | None | - | 2 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
44418923 | 161236 | 0 | None | - | 2 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@H](NC(=O)[C@@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL414087 | 161236 | 0 | None | - | 2 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@H](NC(=O)[C@@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
45482480 | 196198 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 472 | 8 | 4 | 5 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc([N+](=O)[O-])ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL572647 | 196198 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 472 | 8 | 4 | 5 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cc([N+](=O)[O-])ccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
45482477 | 196402 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL574292 | 196402 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
44211352 | 13872 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1196916 | 13872 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL558614 | 13872 | 0 | None | - | 0 | Rat | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
10671800 | 205016 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 463 | 6 | 3 | 6 | 5.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(Cl)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL8997 | 205016 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 463 | 6 | 3 | 6 | 5.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccc(Cl)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
70691750 | 73299 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017833 | 73299 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10555363 | 96040 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 588 | 9 | 1 | 4 | 6.6 | CCC1(CC(=O)Nc2ccccc2)C(=O)N(CC(=O)N(c2ccccc2)C(C)C)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm960205b | ||
CHEMBL262444 | 96040 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 588 | 9 | 1 | 4 | 6.6 | CCC1(CC(=O)Nc2ccccc2)C(=O)N(CC(=O)N(c2ccccc2)C(C)C)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm960205b | ||
155553502 | 173603 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1822 | 72 | 19 | 22 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4547294 | 173603 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1822 | 72 | 19 | 22 | 3.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44303511 | 159213 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 750 | 18 | 4 | 10 | 5.7 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(01)81005-2 | ||
CHEMBL410511 | 159213 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 750 | 18 | 4 | 10 | 5.7 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/S0960-894X(01)81005-2 | ||
70695922 | 73248 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 558 | 6 | 1 | 5 | 5.9 | CCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017691 | 73248 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 558 | 6 | 1 | 5 | 5.9 | CCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
44458101 | 167583 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 363 | 4 | 3 | 3 | 2.0 | O=C(N[C@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL433032 | 167583 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 363 | 4 | 3 | 3 | 2.0 | O=C(N[C@H]1C(=O)N(c2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
72947518 | 140266 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 277 | 2 | 1 | 2 | 2.7 | O=C1C=C(Cl)C(O)(c2ccccc2)N1C1CCCC1 | 10.1039/C6MD00052E | ||
CHEMBL3818781 | 140266 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 277 | 2 | 1 | 2 | 2.7 | O=C1C=C(Cl)C(O)(c2ccccc2)N1C1CCCC1 | 10.1039/C6MD00052E | ||
44348764 | 168067 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 980 | 28 | 11 | 11 | 1.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL436199 | 168067 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 980 | 28 | 11 | 11 | 1.4 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL435339 | 211917 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
89913059 | 140192 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 327 | 6 | 1 | 2 | 4.0 | CCCCCCN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
CHEMBL3817870 | 140192 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 327 | 6 | 1 | 2 | 4.0 | CCCCCCN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
14208261 | 103212 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 397 | 5 | 2 | 3 | 4.2 | CCCc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL308756 | 103212 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 397 | 5 | 2 | 3 | 4.2 | CCCc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
44280371 | 102554 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 815 | 19 | 4 | 8 | 6.6 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30701 | 102554 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 815 | 19 | 4 | 8 | 6.6 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44281020 | 116144 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 6.2 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL33698 | 116144 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 6.2 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
13822910 | 67422 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 383 | 3 | 2 | 2 | 4.7 | O=C1Nc2ccccc2C(c2ccccc2F)=N[C@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL1907930 | 67422 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 383 | 3 | 2 | 2 | 4.7 | O=C1Nc2ccccc2C(c2ccccc2F)=N[C@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
44303488 | 100590 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 501 | 8 | 2 | 6 | 4.1 | CC(Cn1nnc2ccccc21)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL294735 | 100590 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 501 | 8 | 2 | 6 | 4.1 | CC(Cn1nnc2ccccc21)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
10369806 | 116320 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@@H](NC(=O)Nc1cccc(Cl)c1)C[C@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL337937 | 116320 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@@H](NC(=O)Nc1cccc(Cl)c1)C[C@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL218763 | 207654 | 0 | None | -3630 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
44303722 | 100382 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 807 | 20 | 5 | 11 | 4.8 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OC(C)(C)C | 10.1016/S0960-894X(01)81005-2 | ||
CHEMBL293456 | 100382 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 807 | 20 | 5 | 11 | 4.8 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O)n1nnnc1[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)OC(C)(C)C | 10.1016/S0960-894X(01)81005-2 | ||
11756709 | 22674 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 528 | 9 | 3 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCOC(=O)CCC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL132875 | 22674 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 528 | 9 | 3 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCOC(=O)CCC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10435698 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL38404 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
44300745 | 196674 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 562 | 6 | 3 | 5 | 5.3 | COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](C3CCCCC3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL57643 | 196674 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 562 | 6 | 3 | 5 | 5.3 | COC(=O)c1cccc(NC(=O)N[C@@H]2C[C@H](C3CCCCC3)c3ccc(C)cc3N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
10435698 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL38404 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
15104597 | 110061 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 481 | 13 | 2 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
CHEMBL325220 | 110061 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 481 | 13 | 2 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
11028229 | 114956 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 575 | 8 | 3 | 5 | 4.6 | CO[C@@H]1C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C(=O)N1Cc1ccccc1 | 10.1021/jm010898i | ||
CHEMBL3350856 | 114956 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 575 | 8 | 3 | 5 | 4.6 | CO[C@@H]1C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C(=O)N1Cc1ccccc1 | 10.1021/jm010898i | ||
10435698 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL38404 | 140876 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 4.2 | CCOC(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14720390 | 49125 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL156415 | 49125 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
70695933 | 73289 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 607 | 7 | 1 | 6 | 5.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017823 | 73289 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 607 | 7 | 1 | 6 | 5.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
10413618 | 201103 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL62205 | 201103 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
10323690 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL2114401 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL291033 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
11224455 | 196596 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 7 | 3 | 3 | 4.1 | CC1=C(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)Cc2ccccc21 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL575814 | 196596 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 7 | 3 | 3 | 4.1 | CC1=C(C(=O)Nc2ccccc2C(=O)NC(Cc2ccccc2)C(=O)O)Cc2ccccc21 | 10.1016/j.bmc.2009.05.067 | ||
44376132 | 119741 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 6 | 3 | 6 | 3.9 | CC(C)CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL352264 | 119741 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 6 | 3 | 6 | 3.9 | CC(C)CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
90663978 | 106321 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 883 | 23 | 8 | 10 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c(OC)c1 | 10.1021/jm00089a010 | ||
CHEMBL3144542 | 106321 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 883 | 23 | 8 | 10 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c(OC)c1 | 10.1021/jm00089a010 | ||
70695934 | 73297 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 595 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017831 | 73297 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 595 | 8 | 1 | 6 | 5.9 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
44283029 | 99592 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 5.2 | COC(=O)/C=C/C(=O)N[C@H](COC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)c1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL287079 | 99592 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 627 | 11 | 3 | 7 | 5.2 | COC(=O)/C=C/C(=O)N[C@H](COC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)c1ccccc1 | 10.1021/jm00086a017 | ||
10793883 | 106646 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 615 | 8 | 0 | 6 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL316104 | 106646 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 615 | 8 | 0 | 6 | 6.3 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10323690 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2114401 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL291033 | 100032 | 0 | None | - | 2 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
14888722 | 76895 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1055 | 30 | 11 | 14 | -0.2 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(Cc2nnn[nH]2)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079601 | 76895 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 1055 | 30 | 11 | 14 | -0.2 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(Cc2nnn[nH]2)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
44280495 | 98669 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 641 | 10 | 5 | 8 | 3.7 | CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL280980 | 98669 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 641 | 10 | 5 | 8 | 3.7 | CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
10413618 | 201103 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL62205 | 201103 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1021/jm970065l | ||
44349074 | 116535 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 426 | 7 | 4 | 4 | 2.8 | O=C(O)CCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL339041 | 116535 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 426 | 7 | 4 | 4 | 2.8 | O=C(O)CCC(NC(=O)c1cc2ccccc2[nH]1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44333305 | 4982 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 502 | 4 | 2 | 5 | 3.6 | CCCN1C(=O)C(NC(=O)Nc2cccc(C(F)(F)F)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL105273 | 4982 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 502 | 4 | 2 | 5 | 3.6 | CCCN1C(=O)C(NC(=O)Nc2cccc(C(F)(F)F)c2)N=C(N2CCN(C)CC2)c2ccccc21 | 10.1016/0960-894X(95)00530-0 | ||
10430103 | 78105 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 384 | 3 | 3 | 3 | 3.9 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3NC2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL2111921 | 78105 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 384 | 3 | 3 | 3 | 3.9 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3NC2=O)c1 | 10.1021/jm00078a018 | ||
44281004 | 99617 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 15 | 4 | 8 | 6.4 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3cccc(OC(=O)NCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL287295 | 99617 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 15 | 4 | 8 | 6.4 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3cccc(OC(=O)NCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
10838382 | 118826 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 478 | 6 | 3 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCCC1 | 10.1021/jm970065l | ||
CHEMBL344211 | 118826 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 478 | 6 | 3 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NN1CCCCC1 | 10.1021/jm970065l | ||
71449051 | 78076 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CC[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL2111827 | 78076 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 455 | 7 | 3 | 4 | 3.6 | O=C(O)CC[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44381819 | 58307 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL168435 | 58307 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||
10322621 | 57254 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 473 | 7 | 2 | 7 | 4.4 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL166443 | 57254 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 473 | 7 | 2 | 7 | 4.4 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
15514018 | 78186 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 546 | 6 | 3 | 6 | 3.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(c3ccncc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
CHEMBL2112238 | 78186 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 546 | 6 | 3 | 6 | 3.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(c3ccncc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
10580108 | 5042 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 650 | 10 | 1 | 4 | 7.4 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)(Cc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
CHEMBL105619 | 5042 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 650 | 10 | 1 | 4 | 7.4 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)(Cc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
14991574 | 100236 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 836 | 20 | 9 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL292471 | 100236 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 836 | 20 | 9 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
90663996 | 106342 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 919 | 23 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1cccc(OS(=O)(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144565 | 106342 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 919 | 23 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1cccc(OS(=O)(=O)O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
10415786 | 169151 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 577 | 7 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(O)cc1 | 10.1021/jm950626d | ||
CHEMBL443825 | 169151 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 577 | 7 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(O)cc1 | 10.1021/jm950626d | ||
44336539 | 5075 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
15104612 | 109296 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
CHEMBL323249 | 109296 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
CHEMBL2370120 | 208041 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)[C@H](Cc1ccc(CCC(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||||
10318742 | 24803 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccncc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL134657 | 24803 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccncc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
14991542 | 106324 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 893 | 22 | 8 | 8 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144545 | 106324 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 893 | 22 | 8 | 8 | 4.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44280714 | 99571 | 0 | None | - | 1 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 726 | 14 | 6 | 9 | 3.2 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL286908 | 99571 | 0 | None | - | 1 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 726 | 14 | 6 | 9 | 3.2 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
5556 | 201569 | 26 | None | - | 1 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 342 | 1 | 0 | 4 | 4.2 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2 | 10.1021/jm00396a028 | ||
CHEMBL646 | 201569 | 26 | None | - | 1 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 342 | 1 | 0 | 4 | 4.2 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2 | 10.1021/jm00396a028 | ||
13822916 | 189134 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 421 | 3 | 1 | 4 | 5.3 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL51569 | 189134 | 0 | None | - | 0 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 421 | 3 | 1 | 4 | 5.3 | Cc1nnc2n1-c1ccccc1C(c1ccccc1F)=N[C@@H]2Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
44368541 | 168051 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 13 | 5 | 5 | 4.5 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL436065 | 168051 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 590 | 13 | 5 | 5 | 4.5 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44286815 | 162717 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 810 | 20 | 7 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL418622 | 162717 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 810 | 20 | 7 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
155558199 | 174197 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1894 | 75 | 19 | 24 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4561184 | 174197 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1894 | 75 | 19 | 24 | 2.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10346551 | 114138 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 518 | 5 | 3 | 3 | 5.3 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
CHEMBL333813 | 114138 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 518 | 5 | 3 | 3 | 5.3 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)C[C@H](c2ccccc2)c2ccccc21 | 10.1021/jm00048a015 | ||
10485763 | 109188 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 860 | 21 | 8 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Oc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL322635 | 109188 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 860 | 21 | 8 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Oc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
44381815 | 58698 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 4.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL169126 | 58698 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 838 | 21 | 7 | 9 | 4.0 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
15667003 | 96890 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1016 | 27 | 8 | 11 | 2.3 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(CCC)[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL269355 | 96890 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1016 | 27 | 8 | 11 | 2.3 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(CCC)[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
10346998 | 17926 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 532 | 5 | 2 | 3 | 5.7 | CN(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21)C(C)(C)C | 10.1021/jm00048a015 | ||
CHEMBL126865 | 17926 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 532 | 5 | 2 | 3 | 5.7 | CN(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21)C(C)(C)C | 10.1021/jm00048a015 | ||
9962694 | 167671 | 3 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 853 | 21 | 8 | 9 | 3.3 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL433640 | 167671 | 3 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 853 | 21 | 8 | 9 | 3.3 | CN(C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
46234969 | 73294 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 626 | 7 | 1 | 5 | 7.4 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1CC1CCCCC1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017828 | 73294 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 626 | 7 | 1 | 5 | 7.4 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1CC1CCCCC1 | 10.1016/j.bmcl.2012.02.049 | ||
155548381 | 173160 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1720 | 69 | 15 | 20 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4536393 | 173160 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 1720 | 69 | 15 | 20 | 3.8 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL156559 | 207062 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
44396672 | 67176 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 545 | 7 | 2 | 6 | 4.5 | CN(C)c1ccc(N2C(=O)CC3[C@@H](N[C@@H](Cc4c[nH]c5ccccc45)C(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm0498755 | ||
CHEMBL189549 | 67176 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 545 | 7 | 2 | 6 | 4.5 | CN(C)c1ccc(N2C(=O)CC3[C@@H](N[C@@H](Cc4c[nH]c5ccccc45)C(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm0498755 | ||
10918992 | 79133 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 588 | 7 | 3 | 6 | 4.2 | CN(C)c1ccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
CHEMBL2114079 | 79133 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 588 | 7 | 3 | 6 | 4.2 | CN(C)c1ccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)cc1 | 10.1021/jm010813d | ||
13822921 | 101157 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 431 | 3 | 1 | 5 | 4.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)c1ccc(Cl)cc1 | 10.1021/jm00396a028 | ||
CHEMBL298948 | 101157 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 431 | 3 | 1 | 5 | 4.3 | O=C(NC1N=C(c2ccccc2F)c2ccccc2-n2cnnc21)c1ccc(Cl)cc1 | 10.1021/jm00396a028 | ||
10389657 | 24454 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)C(NC(=O)Nc2cccc(Br)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL134340 | 24454 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)C(NC(=O)Nc2cccc(Br)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44329150 | 111908 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 580 | 7 | 3 | 3 | 6.8 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC3(C)CCCCC3)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL329735 | 111908 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 580 | 7 | 3 | 3 | 6.8 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC3(C)CCCCC3)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
10053472 | 78434 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 557 | 8 | 3 | 4 | 4.1 | CC(C)(C)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
CHEMBL2112829 | 78434 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 557 | 8 | 3 | 4 | 4.1 | CC(C)(C)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
15689726 | 106112 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc(Cl)c1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142691 | 106112 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc(Cl)c1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
44370451 | 50518 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL157658 | 50518 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
14991569 | 98343 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 863 | 20 | 9 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2cc(O)ccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL278447 | 98343 | 0 | None | - | 0 | Guinea pig | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 863 | 20 | 9 | 9 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1ccc2cc(O)ccc2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14208192 | 102522 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL306760 | 102522 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00047a021 | ||
14208236 | 202975 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 426 | 3 | 2 | 4 | 3.9 | Cn1c(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73885 | 202975 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 426 | 3 | 2 | 4 | 3.9 | Cn1c(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc2ccccc21 | 10.1021/jm00047a021 | ||
10030842 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm050689o | ||
CHEMBL276837 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm050689o | ||
54581302 | 61593 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc(N2CCN(C(=O)c3ncc(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774041 | 61593 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc(N2CCN(C(=O)c3ncc(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3)CC2)cc2ccccc12 | 10.1016/j.bmcl.2011.03.069 | ||
15667012 | 168484 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL439591 | 168484 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
14208192 | 102522 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL306760 | 102522 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 394 | 3 | 3 | 3 | 3.7 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
14208236 | 202975 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 426 | 3 | 2 | 4 | 3.9 | Cn1c(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL73885 | 202975 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 426 | 3 | 2 | 4 | 3.9 | Cn1c(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc2ccccc21 | 10.1021/jm00120a002 | ||
15667012 | 168484 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL439591 | 168484 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 976 | 28 | 10 | 11 | 1.5 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
10030842 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
CHEMBL276837 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
10030842 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1016/s0960-894x(01)00630-8 | ||
CHEMBL276837 | 98141 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1016/s0960-894x(01)00630-8 | ||
9887120 | 202426 | 3 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL70380 | 202426 | 3 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL319438 | 209471 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
44348651 | 167674 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 952 | 26 | 11 | 11 | 0.6 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL433647 | 167674 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 952 | 26 | 11 | 11 | 0.6 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCNC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
44381578 | 120002 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)CNN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL354512 | 120002 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(O)cc1)CNN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
90663979 | 106326 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 883 | 23 | 8 | 10 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1OC | 10.1021/jm00089a010 | ||
CHEMBL3144548 | 106326 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 883 | 23 | 8 | 10 | 3.3 | COc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1OC | 10.1021/jm00089a010 | ||
44209151 | 59122 | 1 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 301 | 3 | 2 | 2 | 3.8 | O=C(Cc1ccccc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL171108 | 59122 | 1 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 301 | 3 | 2 | 2 | 3.8 | O=C(Cc1ccccc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
14208245 | 203051 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00047a021 | ||
CHEMBL74580 | 203051 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00047a021 | ||
155553269 | 173555 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1818 | 68 | 15 | 22 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N1CCC[C@@H]1C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4545970 | 173555 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1818 | 68 | 15 | 22 | 3.9 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N1CCC[C@@H]1C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44348870 | 114330 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 452 | 7 | 3 | 5 | 3.3 | O=C(O)CCC(NC(=O)c1cnc2ccccc2c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL334171 | 114330 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 452 | 7 | 3 | 5 | 3.3 | O=C(O)CCC(NC(=O)c1cnc2ccccc2c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
44348887 | 117586 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 7 | 3 | 4 | 4.0 | O=C(O)CCC(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL340630 | 117586 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 469 | 7 | 3 | 4 | 4.0 | O=C(O)CCC(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
880 | 2208 | 3 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 10.1021/jm9506736 | ||
9935175 | 2208 | 3 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 10.1021/jm9506736 | ||
CHEMBL2093059 | 2208 | 3 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 487 | 5 | 3 | 7 | 3.5 | O=C(N[C@@H]1N=C(C2CCCCC2)c2c(N(C1=O)C)cccc2)Nc1cccc(c1)N(c1n[nH]nn1)C | 10.1021/jm9506736 | ||
15104628 | 9910 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 534 | 10 | 2 | 5 | 4.6 | CCOC(=O)CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL114926 | 9910 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 534 | 10 | 2 | 5 | 4.6 | CCOC(=O)CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
10369336 | 116255 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 4.5 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL337574 | 116255 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 4.5 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991535 | 106312 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1cccc(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144534 | 106312 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 841 | 22 | 9 | 9 | 2.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1cccc(O)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44366563 | 119165 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.8 | O=C1C(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2)C[C@@H]1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL347058 | 119165 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.8 | O=C1C(Cc2c[nH]c3ccccc23)CN(Cc2ccccc2)C[C@@H]1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL169054 | 207092 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a068 | ||||
11200806 | 137837 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 8 | 3 | 3 | 3.8 | O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1021/jm051050n | ||
CHEMBL377157 | 137837 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 8 | 3 | 3 | 3.8 | O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1021/jm051050n | ||
89913436 | 140257 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 283 | 2 | 1 | 2 | 2.6 | O=C1C=C(Cl)C(O)(c2ccc(Cl)cc2)N1C1CC1 | 10.1039/C6MD00052E | ||
CHEMBL3818705 | 140257 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 283 | 2 | 1 | 2 | 2.6 | O=C1C=C(Cl)C(O)(c2ccc(Cl)cc2)N1C1CC1 | 10.1039/C6MD00052E | ||
15167800 | 32500 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 412 | 4 | 3 | 3 | 4.4 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
CHEMBL141365 | 32500 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 412 | 4 | 3 | 3 | 4.4 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
10369346 | 24764 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 518 | 6 | 3 | 5 | 4.4 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)Nc3ccncc3)C2=O)cc1 | 10.1021/jm00078a018 | ||
CHEMBL134618 | 24764 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 518 | 6 | 3 | 5 | 4.4 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)Nc3ccncc3)C2=O)cc1 | 10.1021/jm00078a018 | ||
CHEMBL169054 | 207092 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(97)00107-8 | ||||
14208211 | 202709 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 311 | 2 | 2 | 3 | 2.1 | CC(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL72057 | 202709 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 311 | 2 | 2 | 3 | 2.1 | CC(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
11200806 | 137837 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 8 | 3 | 3 | 3.8 | O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL377157 | 137837 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 414 | 8 | 3 | 3 | 3.8 | O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O | 10.1016/j.bmc.2009.05.067 | ||
44300550 | 100429 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 376 | 3 | 2 | 3 | 3.7 | Cc1cccc(NC(=O)NC2N=C(C3CCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
CHEMBL293786 | 100429 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 376 | 3 | 2 | 3 | 3.7 | Cc1cccc(NC(=O)NC2N=C(C3CCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
44356801 | 164959 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.6 | C#Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL424076 | 164959 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.6 | C#Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
10696336 | 203624 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 487 | 5 | 3 | 4 | 4.6 | CCCN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)CCC3)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL79565 | 203624 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 487 | 5 | 3 | 4 | 4.6 | CCCN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)CCC3)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
71461592 | 78077 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CC[C@H](NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL2111828 | 78077 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 421 | 7 | 3 | 4 | 3.0 | O=C(O)CC[C@H](NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCC2)CC1 | 10.1021/jm00079a003 | ||
44357068 | 164330 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 5 | 3 | 4 | 3.6 | CN1C(=O)C(NC(=O)NCc2cccc(C(C)(C)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL422102 | 164330 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 5 | 3 | 4 | 3.6 | CN1C(=O)C(NC(=O)NCc2cccc(C(C)(C)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44408524 | 155164 | 0 | None | -169 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL405192 | 155164 | 0 | None | -169 | 4 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
10323431 | 57447 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 493 | 4 | 3 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)N(c2nn[nH]n2)CC3)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
CHEMBL166941 | 57447 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 493 | 4 | 3 | 7 | 2.9 | CN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)N(c2nn[nH]n2)CC3)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9506736 | ||
10056421 | 106145 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
CHEMBL3143025 | 106145 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
14208245 | 203051 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
CHEMBL74580 | 203051 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
CHEMBL317755 | 209459 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NS(C)(=O)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
44578772 | 182214 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-c2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nn2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL479063 | 182214 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 486 | 5 | 0 | 5 | 5.5 | COc1cccc(-c2cc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)nn2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44336565 | 108728 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 671 | 8 | 2 | 7 | 5.7 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C4(C(F)(F)F)N=N4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL321700 | 108728 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 671 | 8 | 2 | 7 | 5.7 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C4(C(F)(F)F)N=N4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
10346957 | 26747 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 531 | 7 | 2 | 4 | 4.9 | CCN(CC)C(=O)C(C)N1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136436 | 26747 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 531 | 7 | 2 | 4 | 4.9 | CCN(CC)C(=O)C(C)N1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10002123 | 78401 | 1 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2112748 | 78401 | 1 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14991539 | 106311 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 859 | 22 | 8 | 8 | 3.8 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144533 | 106311 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 859 | 22 | 8 | 8 | 3.8 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44366345 | 118980 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.8 | O=C1[C@@H](Cc2c[nH]c3ccccc23)CN(Cc2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL345327 | 118980 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 447 | 6 | 2 | 2 | 5.8 | O=C1[C@@H](Cc2c[nH]c3ccccc23)CN(Cc2ccccc2)C[C@H]1Cc1c[nH]c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
19766221 | 118384 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 569 | 7 | 3 | 5 | 5.2 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00163a069 | ||
CHEMBL342256 | 118384 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 569 | 7 | 3 | 5 | 5.2 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1021/jm00163a069 | ||
44280116 | 99171 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 672 | 12 | 3 | 6 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL284183 | 99171 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 672 | 12 | 3 | 6 | 5.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
10392698 | 116803 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 546 | 5 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(Cl)c3)C(=O)N(CC(=O)NC(C)(C)C)c3cc(C)ccc32)cc1 | 10.1021/jm00048a015 | ||
CHEMBL339678 | 116803 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 546 | 5 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(Cl)c3)C(=O)N(CC(=O)NC(C)(C)C)c3cc(C)ccc32)cc1 | 10.1021/jm00048a015 | ||
53465906 | 69069 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 8 | 5 | 4 | 3.7 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)NO)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933108 | 69069 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 456 | 8 | 5 | 4 | 3.7 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)NO)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
44152863 | 119857 | 4 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)C(c2ccccc2)C1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL353189 | 119857 | 4 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)C(c2ccccc2)C1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
71450860 | 78189 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1147 | 14 | 6 | 10 | 9.0 | CC(C)(C)OC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12.CC(C)(C)OC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
CHEMBL2112273 | 78189 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 1147 | 14 | 6 | 10 | 9.0 | CC(C)(C)OC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12.CC(C)(C)OC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
14208301 | 105174 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 3 | 1 | 4 | 3.3 | CN1C(=O)C(NC(=O)c2ccc(C#N)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL312524 | 105174 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 3 | 1 | 4 | 3.3 | CN1C(=O)C(NC(=O)c2ccc(C#N)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
10555571 | 104098 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 8 | 0 | 6 | 5.9 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
CHEMBL310466 | 104098 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 8 | 0 | 6 | 5.9 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
155533520 | 171262 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 910 | 26 | 8 | 9 | 2.5 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4468598 | 171262 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 910 | 26 | 8 | 9 | 2.5 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10555571 | 104098 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 8 | 0 | 6 | 5.9 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL310466 | 104098 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 601 | 8 | 0 | 6 | 5.9 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3nn(C)c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10841358 | 205687 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccc(F)cc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL94005 | 205687 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 605 | 8 | 1 | 5 | 6.0 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccc(F)cc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
44334354 | 4553 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 9 | 2 | 4 | 5.0 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL102879 | 4553 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 517 | 9 | 2 | 4 | 5.0 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44300744 | 101483 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 542 | 6 | 4 | 4 | 4.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL301261 | 101483 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 542 | 6 | 4 | 4 | 4.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)O)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
10623795 | 205553 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1ccccc1NC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(OC(C)C)c1 | 10.1021/jm970373j | ||
CHEMBL9319 | 205553 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1ccccc1NC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(OC(C)C)c1 | 10.1021/jm970373j | ||
10478431 | 9806 | 7 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL114325 | 9806 | 7 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 14 | 2 | 3 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2c1 | 10.1021/jm00124a003 | ||
14519981 | 9965 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00124a003 | ||
CHEMBL115269 | 9965 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00124a003 | ||
15104618 | 108554 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 13 | 3 | 2 | 6.8 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
CHEMBL321265 | 108554 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 13 | 3 | 2 | 6.8 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
44281078 | 99282 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 5.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CCOC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL284975 | 99282 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 773 | 16 | 4 | 8 | 5.9 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CCOC(=O)NCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
193319 | 20576 | 5 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 268 | 1 | 0 | 2 | 2.6 | CN1C(=O)CN=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL13095 | 20576 | 5 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 268 | 1 | 0 | 2 | 2.6 | CN1C(=O)CN=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL120632 | 206863 | 30 | None | - | 3 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/0960-894X(94)85022-4 | ||||
11729474 | 4603 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 420 | 2 | 2 | 5 | 2.1 | Cc1cccc(NC(=O)NC2N=C(N3CCN(C)CC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL103229 | 4603 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 420 | 2 | 2 | 5 | 2.1 | Cc1cccc(NC(=O)NC2N=C(N3CCN(C)CC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
14208302 | 67403 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 3 | 1 | 4 | 3.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C#N)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907847 | 67403 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 412 | 3 | 1 | 4 | 3.3 | CN1C(=O)[C@@H](NC(=O)c2ccc(C#N)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
24785432 | 180979 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 530 | 7 | 0 | 5 | 6.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(CC)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476725 | 180979 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 530 | 7 | 0 | 5 | 6.6 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(CC)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
24785176 | 180981 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 500 | 5 | 0 | 4 | 6.5 | CCc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476747 | 180981 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 500 | 5 | 0 | 4 | 6.5 | CCc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL169178 | 207094 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CCOC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
15104613 | 109826 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00116a002 | ||
CHEMBL323854 | 109826 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c[nH]c2ccccc12 | 10.1021/jm00116a002 | ||
10364355 | 27743 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 412 | 4 | 2 | 3 | 3.9 | C[C@H](NC(=O)NC1N=C(c2ccccc2)c2ccccc2N(C)C1=O)c1ccccc1 | 10.1021/jm00078a018 | ||
CHEMBL137208 | 27743 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 412 | 4 | 2 | 3 | 3.9 | C[C@H](NC(=O)NC1N=C(c2ccccc2)c2ccccc2N(C)C1=O)c1ccccc1 | 10.1021/jm00078a018 | ||
44280266 | 98322 | 0 | None | - | 1 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 729 | 14 | 4 | 7 | 5.0 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL278217 | 98322 | 0 | None | - | 1 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 729 | 14 | 4 | 7 | 5.0 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80273-5 | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80273-5 | ||
59923871 | 73612 | 1 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCC(NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
CHEMBL2021374 | 73612 | 1 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCC(NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80156-0 | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00105a062 | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00105a062 | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00105a062 | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm00105a062 | ||
14802537 | 85561 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL2304062 | 85561 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80685-X | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(00)80685-X | ||
14802538 | 96241 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL263969 | 96241 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(97)00356-9 | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1016/S0960-894X(97)00356-9 | ||
44368727 | 119000 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 598 | 12 | 5 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL345511 | 119000 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 598 | 12 | 5 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
44153340 | 31459 | 5 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 413 | 3 | 0 | 4 | 3.8 | CN1c2ccccc2C(c2ccccc2F)=NCC1CN1C(=O)c2ccccc2C1=O | 10.1021/jm00163a069 | ||
CHEMBL140516 | 31459 | 5 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 413 | 3 | 0 | 4 | 3.8 | CN1c2ccccc2C(c2ccccc2F)=NCC1CN1C(=O)c2ccccc2C1=O | 10.1021/jm00163a069 | ||
108187 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm970065l | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm970065l | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm970065l | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm970065l | ||
14802539 | 76199 | 1 | None | - | 1 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2062144 | 76199 | 1 | None | - | 1 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
136060577 | 87248 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 4 | 1 | 5 | 6.3 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccccc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL233647 | 87248 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 495 | 4 | 1 | 5 | 6.3 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccccc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
44369595 | 167962 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 475 | 7 | 2 | 7 | 4.2 | Cc1cccc(NCNC2N=C(c3nccs3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL435447 | 167962 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 475 | 7 | 2 | 7 | 4.2 | Cc1cccc(NCNC2N=C(c3nccs3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
9978270 | 78402 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 399 | 3 | 3 | 4 | 3.2 | CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2112749 | 78402 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 399 | 3 | 3 | 4 | 3.2 | CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10323637 | 105705 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.6 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL313813 | 105705 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.6 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm00078a018 | ||
10323637 | 105705 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.6 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL313813 | 105705 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.6 | CCN(CC)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm9608523 | ||
10973981 | 78024 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 590 | 7 | 3 | 7 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
CHEMBL2111548 | 78024 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 590 | 7 | 3 | 7 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)C[C@@H]12 | 10.1021/jm010813d | ||
46234970 | 73293 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 7 | 1 | 5 | 6.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017827 | 73293 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 620 | 7 | 1 | 5 | 6.7 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccc1 | 10.1016/j.bmcl.2012.02.049 | ||
10051431 | 120613 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 6 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL357502 | 120613 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 6 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
44336487 | 110512 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 699 | 9 | 2 | 7 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C4(C(F)(F)F)N=N4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL326251 | 110512 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 699 | 9 | 2 | 7 | 6.5 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C4(C(F)(F)F)N=N4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
14802525 | 116227 | 1 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 12 | 5 | 5 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL337384 | 116227 | 1 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 12 | 5 | 5 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
44368613 | 120489 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 610 | 12 | 5 | 4 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL356419 | 120489 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 610 | 12 | 5 | 4 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
73351319 | 167601 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 648 | 12 | 5 | 5 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCP(C)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL433148 | 167601 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 648 | 12 | 5 | 5 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCP(C)(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL282175 | 98863 | 0 | None | - | 1 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 769 | 16 | 6 | 11 | 4.6 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CCOC(=O)NCCCC(=O)NCCSCc3csc(C=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
44591882 | 178397 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 466 | 7 | 5 | 3 | 4.3 | O=C(Nc1ccccc1C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL470622 | 178397 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 466 | 7 | 5 | 3 | 4.3 | O=C(Nc1ccccc1C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
10789229 | 97928 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 6 | 3 | 7 | 3.8 | CCOc1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL275307 | 97928 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 440 | 6 | 3 | 7 | 3.8 | CCOc1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
10091467 | 116205 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2ccccn2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL337285 | 116205 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 385 | 3 | 2 | 4 | 3.0 | CN1C(=O)C(NC(=O)Nc2ccccn2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44362744 | 34447 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 546 | 7 | 4 | 5 | 3.5 | CC(C)(C)OC(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](CC(=O)O)Cc3ccccc3)N2C1=O | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL143012 | 34447 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 546 | 7 | 4 | 5 | 3.5 | CC(C)(C)OC(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](CC(=O)O)Cc3ccccc3)N2C1=O | 10.1016/s0960-894x(98)00677-5 | ||
40875375 | 198366 | 1 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 9 | 4 | 3 | 4.8 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12)OCc1ccccc1 | 10.1016/S0960-894X(97)00346-6 | ||
CHEMBL59561 | 198366 | 1 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 480 | 9 | 4 | 3 | 4.8 | O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12)OCc1ccccc1 | 10.1016/S0960-894X(97)00346-6 | ||
11801355 | 116368 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 580 | 8 | 3 | 6 | 3.6 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1021/jm000959x | ||
CHEMBL338186 | 116368 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 580 | 8 | 3 | 6 | 3.6 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1021/jm000959x | ||
44360340 | 32485 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 457 | 5 | 1 | 4 | 5.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)Cc1cccc2sccc12 | 10.1021/jm00163a069 | ||
CHEMBL141354 | 32485 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 457 | 5 | 1 | 4 | 5.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)Cc1cccc2sccc12 | 10.1021/jm00163a069 | ||
89913625 | 140230 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 293 | 6 | 1 | 2 | 3.4 | CCCCCCN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3818303 | 140230 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 293 | 6 | 1 | 2 | 3.4 | CCCCCCN1C(=O)C=C(Cl)C1(O)c1ccccc1 | 10.1039/C6MD00052E | ||
14802538 | 96241 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL263969 | 96241 | 0 | None | - | 0 | Rat | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
44334033 | 107319 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 475 | 6 | 2 | 4 | 4.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL319196 | 107319 | 0 | None | - | 0 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 475 | 6 | 2 | 4 | 4.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
57390472 | 67413 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 3.3 | COc1cccc(CC(=O)N[C@@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00120a002 | ||
CHEMBL1907856 | 67413 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 3.3 | COc1cccc(CC(=O)N[C@@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00120a002 | ||
44359881 | 118797 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)CCC(=O)OCc1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL343969 | 118797 | 0 | None | - | 0 | Rat | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 473 | 8 | 1 | 5 | 4.1 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)CCC(=O)OCc1ccccc1 | 10.1021/jm00163a069 | ||
10574611 | 205520 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 429 | 6 | 3 | 6 | 4.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccccc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9291 | 205520 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 429 | 6 | 3 | 6 | 4.3 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3ccccc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL171310 | 207104 | 0 | None | - | 0 | Mouse | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CC(=O)N[C@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
10010811 | 106126 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||
CHEMBL3142898 | 106126 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 854 | 21 | 9 | 9 | 3.5 | CC(=O)c1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||
42636923 | 178253 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL469341 | 178253 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
15104624 | 9905 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 514 | 13 | 2 | 4 | 5.7 | CCCCCN(CCCCC)C(=O)[C@@H](CC1C(=O)Nc2ccccc21)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL114913 | 9905 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 514 | 13 | 2 | 4 | 5.7 | CCCCCN(CCCCC)C(=O)[C@@H](CC1C(=O)Nc2ccccc21)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
10341040 | 116109 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN1C(=O)C(NC(=O)Nc2ccc(F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL336749 | 116109 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN1C(=O)C(NC(=O)Nc2ccc(F)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
10393441 | 171147 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 580 | 7 | 3 | 3 | 6.5 | CC(C)(NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL446682 | 171147 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 580 | 7 | 3 | 3 | 6.5 | CC(C)(NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm00048a015 | ||
44362685 | 121327 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL358989 | 121327 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 680 | 12 | 3 | 6 | 5.7 | C[Si](C)(C)CCOC(=O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
14720386 | 48060 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 463 | 12 | 2 | 4 | 4.4 | CCCN(CCC)C(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL155406 | 48060 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 463 | 12 | 2 | 4 | 4.4 | CCCN(CCC)C(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
44281005 | 116231 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 6.4 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CCOC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL33743 | 116231 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 6.4 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CCOC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00249-1 | ||
44592046 | 178328 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 393 | 6 | 3 | 3 | 4.0 | CC(C)C[C@H](NC(=O)N(C(=O)c1cc2ccccc2[nH]1)c1ccccc1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL469980 | 178328 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 393 | 6 | 3 | 3 | 4.0 | CC(C)C[C@H](NC(=O)N(C(=O)c1cc2ccccc2[nH]1)c1ccccc1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
10347746 | 16622 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 6 | 3 | 3 | 6.2 | CC1(NC(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(Cl)c3)C[C@H](c3ccccc3)c3ccccc32)CCCCC1 | 10.1021/jm00048a015 | ||
CHEMBL124611 | 16622 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 558 | 6 | 3 | 3 | 6.2 | CC1(NC(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(Cl)c3)C[C@H](c3ccccc3)c3ccccc32)CCCCC1 | 10.1021/jm00048a015 | ||
44368633 | 46282 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 12 | 5 | 5 | 4.3 | C[C@@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL153787 | 46282 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 12 | 5 | 5 | 4.3 | C[C@@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CNC(=O)/C=C/C(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
115208 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm00163a069 | ||
1667 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm00163a069 | ||
CHEMBL169703 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm00163a069 | ||
10769565 | 17790 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 8 | 3 | 6 | 3.6 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
CHEMBL126160 | 17790 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 580 | 8 | 3 | 6 | 3.6 | COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
9982757 | 51196 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 483 | 5 | 2 | 5 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL158235 | 51196 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 483 | 5 | 2 | 5 | 4.3 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
44381562 | 168049 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 827 | 22 | 10 | 9 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NNC[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL436053 | 168049 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 827 | 22 | 10 | 9 | 3.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NNC[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80680-0 | ||
11505691 | 140394 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)[C@@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1021/jm049072h | ||
CHEMBL382263 | 140394 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)[C@@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1021/jm049072h | ||
9891461 | 164470 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 483 | 5 | 2 | 5 | 4.3 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL422604 | 164470 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 483 | 5 | 2 | 5 | 4.3 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
15104598 | 109295 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 481 | 13 | 2 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
CHEMBL323245 | 109295 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 481 | 13 | 2 | 2 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1 | 10.1021/jm00116a002 | ||
14208258 | 102483 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(F)cc1 | 10.1021/jm00047a021 | ||
CHEMBL306394 | 102483 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(F)cc1 | 10.1021/jm00047a021 | ||
10769675 | 205470 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1cccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)c1 | 10.1021/jm970265x | ||
CHEMBL92586 | 205470 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 587 | 8 | 1 | 5 | 5.9 | COc1cccc(N(C(=O)CN2C(=O)C(Cc3n[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)c1 | 10.1021/jm970265x | ||
14208200 | 203011 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 5 | 3 | 3 | 4.0 | O=C(CCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL74181 | 203011 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 5 | 3 | 3 | 4.0 | O=C(CCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
44341613 | 9522 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 516 | 13 | 2 | 3 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccc(F)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL112622 | 9522 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 516 | 13 | 2 | 3 | 6.4 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccc(F)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
52940616 | 17955 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269263 | 17955 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 581 | 7 | 1 | 6 | 5.7 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(c2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
10453063 | 106508 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 391 | 2 | 2 | 4 | 3.0 | Cc1cccc(NC(=O)NC2N=C(N3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL315214 | 106508 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 391 | 2 | 2 | 4 | 3.0 | Cc1cccc(NC(=O)NC2N=C(N3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
21842331 | 43292 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 522 | 7 | 2 | 4 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)CC3CCCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL150869 | 43292 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 522 | 7 | 2 | 4 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)CC3CCCCC3)C2=O)c1 | 10.1016/0960-894X(95)00556-9 | ||
73349791 | 204093 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 664 | 13 | 5 | 6 | 5.2 | CCOP(=O)(O)CC(=O)N[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL83244 | 204093 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 664 | 13 | 5 | 6 | 5.2 | CCOP(=O)(O)CC(=O)N[C@H](CNC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1021/jm00092a007 | ||
14208258 | 102483 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(F)cc1 | 10.1021/jm00120a002 | ||
CHEMBL306394 | 102483 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 373 | 3 | 2 | 3 | 3.4 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc(F)cc1 | 10.1021/jm00120a002 | ||
44370461 | 119061 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL346070 | 119061 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
10453063 | 106508 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 391 | 2 | 2 | 4 | 3.0 | Cc1cccc(NC(=O)NC2N=C(N3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL315214 | 106508 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 391 | 2 | 2 | 4 | 3.0 | Cc1cccc(NC(=O)NC2N=C(N3CCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
14208200 | 203011 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 5 | 3 | 3 | 4.0 | O=C(CCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL74181 | 203011 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 422 | 5 | 3 | 3 | 4.0 | O=C(CCc1c[nH]c2ccccc12)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
19766220 | 31718 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 395 | 4 | 2 | 4 | 3.8 | CN1c2ccccc2C(c2ccccc2F)NCC1CNC(=O)c1ccsc1 | 10.1021/jm00163a069 | ||
CHEMBL140749 | 31718 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 395 | 4 | 2 | 4 | 3.8 | CN1c2ccccc2C(c2ccccc2F)NCC1CNC(=O)c1ccsc1 | 10.1021/jm00163a069 | ||
10323073 | 25207 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 3.8 | CCOC(=O)CN1C(=O)C(NC(=O)N[C@@H](C)c2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL134987 | 25207 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 484 | 7 | 2 | 5 | 3.8 | CCOC(=O)CN1C(=O)C(NC(=O)N[C@@H](C)c2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44280252 | 99391 | 0 | None | - | 0 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 655 | 11 | 5 | 8 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL285746 | 99391 | 0 | None | - | 0 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 655 | 11 | 5 | 8 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
6604124 | 55311 | 3 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL1315743 | 55311 | 3 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL162111 | 55311 | 3 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
70682900 | 77496 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 385 | 3 | 2 | 3 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1C[C@@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL2092991 | 77496 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 385 | 3 | 2 | 3 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1C[C@@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
20063212 | 166588 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 395 | 3 | 0 | 3 | 4.5 | CN1CC(CC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL429063 | 166588 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 395 | 3 | 0 | 3 | 4.5 | CN1CC(CC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
44349353 | 116342 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 415 | 7 | 3 | 4 | 3.0 | Cc1cc(C)cc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
CHEMBL338045 | 116342 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 415 | 7 | 3 | 4 | 3.0 | Cc1cc(C)cc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
44381852 | 58734 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)O | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL169398 | 58734 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 723 | 20 | 7 | 8 | 3.2 | CCCC[C@H](N[C@@H](C#N)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)O | 10.1016/S0960-894X(97)00107-8 | ||
44361604 | 31262 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 621 | 8 | 3 | 4 | 4.9 | O=C(N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CC3CC(CC(C3)C1)C2 | 10.1021/jm991078x | ||
CHEMBL140320 | 31262 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 621 | 8 | 3 | 4 | 4.9 | O=C(N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C12CC3CC(CC(C3)C1)C2 | 10.1021/jm991078x | ||
44381730 | 13851 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 450 | 8 | 2 | 4 | 2.5 | CN1CCN(C(=O)CCC(NC(=O)c2cccc(Cl)c2)C(=O)NCCC(C)(C)C)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1196729 | 13851 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 450 | 8 | 2 | 4 | 2.5 | CN1CCN(C(=O)CCC(NC(=O)c2cccc(Cl)c2)C(=O)NCCC(C)(C)C)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL557997 | 13851 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 450 | 8 | 2 | 4 | 2.5 | CN1CCN(C(=O)CCC(NC(=O)c2cccc(Cl)c2)C(=O)NCCC(C)(C)C)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
10320031 | 77472 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092868 | 77472 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 421 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
90663981 | 106328 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144550 | 106328 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 891 | 21 | 8 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
70689603 | 73247 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 8 | 1 | 6 | 5.5 | COCCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017690 | 73247 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 8 | 1 | 6 | 5.5 | COCCC1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
52946666 | 17952 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269260 | 17952 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 600 | 9 | 2 | 7 | 5.6 | CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(Nc2cccc(C(=O)O)c2)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2010.08.115 | ||
44300743 | 100492 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 572 | 6 | 4 | 6 | 4.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL294161 | 100492 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 572 | 6 | 4 | 6 | 4.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
11679146 | 134832 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1021/jm049072h | ||
CHEMBL372773 | 134832 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 667 | 9 | 2 | 6 | 5.8 | COc1ccc(N(C)C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1021/jm049072h | ||
11741582 | 27753 | 6 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 398 | 4 | 2 | 3 | 3.3 | CN1C(=O)C(NC(=O)NCc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137213 | 27753 | 6 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 398 | 4 | 2 | 3 | 3.3 | CN1C(=O)C(NC(=O)NCc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10029145 | 97718 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 504 | 7 | 2 | 5 | 4.6 | CCOC(=O)CCN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL273919 | 97718 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 504 | 7 | 2 | 5 | 4.6 | CCOC(=O)CCN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10693825 | 205327 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 428 | 5 | 3 | 6 | 3.9 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N(C)C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9171 | 205327 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 428 | 5 | 3 | 6 | 3.9 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(N(C)C)c2)c1 | 10.1021/jm970373j | ||
6604124 | 55311 | 3 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL1315743 | 55311 | 3 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL162111 | 55311 | 3 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
10528637 | 96855 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 477 | 6 | 3 | 7 | 4.4 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2)c1 | 10.1021/jm970373j | ||
CHEMBL269123 | 96855 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 477 | 6 | 3 | 7 | 4.4 | CCOC(=O)c1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(Cl)c2)c1 | 10.1021/jm970373j | ||
14208229 | 102693 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 430 | 3 | 3 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL308111 | 102693 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 430 | 3 | 3 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00120a002 | ||
14208229 | 102693 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 430 | 3 | 3 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL308111 | 102693 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 430 | 3 | 3 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(F)ccc2[nH]1 | 10.1021/jm00047a021 | ||
44306823 | 201378 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 802 | 20 | 9 | 7 | 2.8 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CCCCNC(=O)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL63707 | 201378 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 802 | 20 | 9 | 7 | 2.8 | CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CCCCNC(=O)Nc1ccccc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
3081191 | 9457 | 9 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00124a003 | ||
CHEMBL112307 | 9457 | 9 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00124a003 | ||
3081191 | 9457 | 9 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL112307 | 9457 | 9 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
44293812 | 101245 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 645 | 5 | 2 | 4 | 5.9 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(Br)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL299523 | 101245 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 645 | 5 | 2 | 4 | 5.9 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(Br)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
11027990 | 67192 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL189634 | 67192 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
44330874 | 206621 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 974 | 28 | 10 | 11 | 2.1 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N/C(=C\c1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL99499 | 206621 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 974 | 28 | 10 | 11 | 2.1 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N/C(=C\c1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
10056407 | 119643 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 854 | 20 | 7 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL351364 | 119643 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 854 | 20 | 7 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL318570 | 209469 | 0 | None | - | 0 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
CHEMBL438911 | 212058 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
24785180 | 180958 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 6 | 0 | 5 | 6.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476531 | 180958 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 536 | 6 | 0 | 5 | 6.7 | CCOc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
11803697 | 106134 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
136898911 | 106134 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
CHEMBL3142912 | 106134 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 857 | 21 | 9 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm960509y | ||
15667013 | 106922 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 920 | 26 | 10 | 11 | 0.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL318010 | 106922 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 920 | 26 | 10 | 11 | 0.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL319439 | 209472 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||||
3960 | 2313 | 20 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00079a003 | ||
891 | 2313 | 20 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00079a003 | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm00079a003 | ||
44349077 | 117338 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL340263 | 117338 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00079a003 | ||
10483574 | 6129 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 591 | 8 | 2 | 5 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL108130 | 6129 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 591 | 8 | 2 | 5 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
13605417 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80681-2 | ||
10458620 | 114048 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 4 | 5.4 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
CHEMBL333718 | 114048 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 4 | 5.4 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)c3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1021/jm00048a015 | ||
13605417 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/S0960-894X(00)80687-3 | ||
14991580 | 100241 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 829 | 21 | 8 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1cccs1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL292490 | 100241 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 829 | 21 | 8 | 9 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1cccs1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
10507109 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
CHEMBL321761 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm9601664 | ||
10507109 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm950626d | ||
CHEMBL321761 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm950626d | ||
10507109 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
CHEMBL321761 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/S0960-894X(97)00062-0 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
11039204 | 78180 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 7 | 3 | 6 | 4.2 | CN(C)c1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
CHEMBL2112231 | 78180 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 588 | 7 | 3 | 6 | 4.2 | CN(C)c1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
14208265 | 202804 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00120a002 | ||
CHEMBL72616 | 202804 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00120a002 | ||
14802530 | 21417 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL131754 | 21417 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
15104607 | 162861 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 497 | 13 | 2 | 2 | 6.9 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2ccccc12 | 10.1021/jm00116a002 | ||
CHEMBL419585 | 162861 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 497 | 13 | 2 | 2 | 6.9 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2ccccc12 | 10.1021/jm00116a002 | ||
44334305 | 109231 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 514 | 9 | 3 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL322913 | 109231 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 514 | 9 | 3 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](COCc2ccccc2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
101918113 | 114915 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 650 | 14 | 6 | 7 | 0.7 | CS[C@H]1C[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)C1 | 10.1021/jm00001a019 | ||
CHEMBL3350334 | 114915 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 650 | 14 | 6 | 7 | 0.7 | CS[C@H]1C[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)C1 | 10.1021/jm00001a019 | ||
CHEMBL407736 | 210933 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||||
44211354 | 12755 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 6 | 1 | 4 | 4.2 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1188705 | 12755 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 6 | 1 | 4 | 4.2 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL537171 | 12755 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 536 | 6 | 1 | 4 | 4.2 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
44280740 | 99941 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 6.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CCOC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL290122 | 99941 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 6.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CCOC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL289310 | 209126 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00378a012 | ||||
20063240 | 13539 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 480 | 6 | 2 | 4 | 4.7 | CC(C)CC(N)C(=O)N1CC(CC2N=C(c3ccccc3)c3ccccc3NC2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1194526 | 13539 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 480 | 6 | 2 | 4 | 4.7 | CC(C)CC(N)C(=O)N1CC(CC2N=C(c3ccccc3)c3ccccc3NC2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL552817 | 13539 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 480 | 6 | 2 | 4 | 4.7 | CC(C)CC(N)C(=O)N1CC(CC2N=C(c3ccccc3)c3ccccc3NC2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
15614807 | 67385 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 365 | 3 | 2 | 2 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL1907740 | 67385 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 365 | 3 | 2 | 2 | 4.6 | O=C1Nc2ccccc2C(c2ccccc2)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
14208265 | 202804 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00047a021 | ||
CHEMBL72616 | 202804 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 423 | 3 | 2 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00047a021 | ||
887 | 4047 | 24 | None | - | 4 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm960669+ | ||
9870520 | 4047 | 24 | None | - | 4 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm960669+ | ||
CHEMBL324547 | 4047 | 24 | None | - | 4 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm960669+ | ||
DB12355 | 4047 | 24 | None | - | 4 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm960669+ | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL3142692 | 209386 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc(Cl)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
10070677 | 161175 | 13 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
CHEMBL41361 | 161175 | 13 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00121a004 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
54580263 | 61528 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(F)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773878 | 61528 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2cccc(F)c2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
15104611 | 108770 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(O)c2ccccc2n1 | 10.1021/jm00116a002 | ||
CHEMBL321811 | 108770 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 514 | 13 | 3 | 4 | 6.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(O)c2ccccc2n1 | 10.1021/jm00116a002 | ||
15104601 | 169861 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL444847 | 169861 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL99786 | 214152 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
73355867 | 204537 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 680 | 12 | 5 | 6 | 6.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1ccccc1O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL86879 | 204537 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 680 | 12 | 5 | 6 | 6.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1ccccc1O)c1ccccc1 | 10.1021/jm00092a007 | ||
10501974 | 96527 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 415 | 5 | 3 | 6 | 3.9 | COc1cccc(-n2c(NNC(=O)Nc3cccc(C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL266376 | 96527 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 415 | 5 | 3 | 6 | 3.9 | COc1cccc(-n2c(NNC(=O)Nc3cccc(C)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL436451 | 211933 | 0 | None | - | 0 | Mouse | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
44368522 | 118976 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 574 | 11 | 5 | 5 | 4.4 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC[C@H](NC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL345303 | 118976 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 574 | 11 | 5 | 5 | 4.4 | C[C@H]1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC[C@H](NC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL382349 | 210555 | 0 | None | -3235 | 4 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
44591825 | 183524 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCCC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL482571 | 183524 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 411 | 8 | 4 | 4 | 3.4 | CSCCC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
14991576 | 101744 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 866 | 21 | 9 | 9 | 3.4 | COc1ccc2[nH]c(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(N)=O)cc2c1 | 10.1021/jm00089a010 | ||
CHEMBL302911 | 101744 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 866 | 21 | 9 | 9 | 3.4 | COc1ccc2[nH]c(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(N)=O)cc2c1 | 10.1021/jm00089a010 | ||
51353551 | 17950 | 10 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
CHEMBL1269257 | 17950 | 10 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmcl.2010.08.115 | ||
10414170 | 170051 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL445095 | 170051 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1016/S0960-894X(00)80683-6 | ||
44300989 | 100511 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 625 | 7 | 4 | 6 | 4.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(C)(=O)=O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL294252 | 100511 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 625 | 7 | 4 | 6 | 4.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(C)(=O)=O)c1)C[C@@H]2C1CCCCC1 | 10.1016/0960-894X(95)00327-P | ||
44382624 | 119853 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 619 | 12 | 4 | 4 | 4.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/c1ccccc1)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL353148 | 119853 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 619 | 12 | 4 | 4 | 4.0 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/c1ccccc1)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||
10414170 | 170051 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00121a004 | ||
CHEMBL445095 | 170051 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00121a004 | ||
15104602 | 9361 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL111808 | 9361 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 486 | 13 | 3 | 2 | 6.2 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00116a002 | ||
44366583 | 120782 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 420 | 4 | 1 | 5 | 4.9 | CC(C)(C)OC(=O)n1cc(CC2CN(Cc3ccccc3)CCC2O)c2ccccc21 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL358016 | 120782 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 420 | 4 | 1 | 5 | 4.9 | CC(C)(C)OC(=O)n1cc(CC2CN(Cc3ccccc3)CCC2O)c2ccccc21 | 10.1016/0960-894X(94)80030-8 | ||
73354294 | 106485 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 636 | 11 | 6 | 5 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CP(=O)(O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL315055 | 106485 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 636 | 11 | 6 | 5 | 4.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CP(=O)(O)O)c1ccccc1 | 10.1021/jm00092a007 | ||
15104610 | 9594 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 513 | 13 | 3 | 3 | 6.6 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2cc(O)ccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL113041 | 9594 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 513 | 13 | 3 | 3 | 6.6 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2cc(O)ccc2c1 | 10.1021/jm00116a002 | ||
44280388 | 116369 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 759 | 15 | 4 | 8 | 5.0 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL33819 | 116369 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 759 | 15 | 4 | 8 | 5.0 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44334330 | 4960 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 435 | 7 | 2 | 3 | 4.7 | Cc1cccc(NC(=O)N[C@@H](CC(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105153 | 4960 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 435 | 7 | 2 | 3 | 4.7 | Cc1cccc(NC(=O)N[C@@H](CC(C)C)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44381319 | 120213 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 11 | 4 | 5 | 3.6 | N#C[C@H](N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL354817 | 120213 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 495 | 11 | 4 | 5 | 3.6 | N#C[C@H](N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
10626596 | 112284 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 555 | 7 | 1 | 4 | 5.6 | O=C1C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc2N1CC(=O)N(c1ccccc1)C1CC1 | 10.1021/jm970265x | ||
CHEMBL330566 | 112284 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 555 | 7 | 1 | 4 | 5.6 | O=C1C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc2N1CC(=O)N(c1ccccc1)C1CC1 | 10.1021/jm970265x | ||
44327457 | 106854 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL317577 | 106854 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL262767 | 208803 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | Cc1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00113a023 | ||||
CHEMBL262767 | 208803 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | Cc1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||||
CHEMBL262767 | 208803 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | Cc1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00173a006 | ||||
44333311 | 4194 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 6 | 2 | 5 | 3.5 | CCCc1cccc(NC(=O)NC2N=C(N3CCN(C)CC3)c3ccccc3N(CCC)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL100502 | 4194 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 476 | 6 | 2 | 5 | 3.5 | CCCc1cccc(NC(=O)NC2N=C(N3CCN(C)CC3)c3ccccc3N(CCC)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
44303481 | 100232 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 524 | 9 | 3 | 6 | 4.3 | CC(=O)Nc1nc(CC(C)(NC(=O)OC2C3CC4CC(C3)CC2C4)C(=O)NCCc2ccccc2)cs1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL292422 | 100232 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 524 | 9 | 3 | 6 | 4.3 | CC(=O)Nc1nc(CC(C)(NC(=O)OC2C3CC4CC(C3)CC2C4)C(=O)NCCc2ccccc2)cs1 | 10.1016/S0960-894X(97)00356-9 | ||
10789887 | 205694 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 6 | 3 | 7 | 4.2 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9405 | 205694 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 454 | 6 | 3 | 7 | 4.2 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
45482492 | 196307 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 495 | 7 | 4 | 3 | 4.9 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cccc(C(F)(F)F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL573560 | 196307 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 495 | 7 | 4 | 3 | 4.9 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2cccc(C(F)(F)F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
10370499 | 36721 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL145133 | 36721 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
10370499 | 36721 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL145133 | 36721 | 0 | None | - | 1 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/s0960-894x(98)00677-5 | ||
10370499 | 85563 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL2304064 | 85563 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 557 | 10 | 4 | 4 | 5.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10769315 | 16662 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
CHEMBL124798 | 16662 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 566 | 8 | 4 | 5 | 3.5 | O=C(N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@H](Cc3ccccc3)C(=O)O)N2C1=O)OCc1ccccc1 | 10.1021/jm000959x | ||
11621814 | 140708 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
CHEMBL382953 | 140708 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
10507109 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
CHEMBL321761 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
44370473 | 50589 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL157722 | 50589 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
44280213 | 101147 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 685 | 12 | 5 | 9 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL29888 | 101147 | 0 | None | - | 1 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 685 | 12 | 5 | 9 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCSCc4csc(N=C(N)N)n4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
70697518 | 77453 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 367 | 3 | 2 | 3 | 4.4 | O=C1Nc2ccccc2C(c2ccccc2)=NC1C[C@@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL2092748 | 77453 | 0 | None | - | 0 | Guinea pig | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 367 | 3 | 2 | 3 | 4.4 | O=C1Nc2ccccc2C(c2ccccc2)=NC1C[C@@H]1CNc2ccccc21 | 10.1021/jm00390a019 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
44283087 | 120311 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 500 | 8 | 2 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)OCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL35580 | 120311 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 500 | 8 | 2 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)OCCc1ccccc1 | 10.1021/jm00086a017 | ||
45482494 | 196308 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL573561 | 196308 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1cc2cccc(F)c2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
54582288 | 61541 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773893 | 61541 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 515 | 5 | 0 | 6 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccccc2C)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
90663977 | 106317 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 823 | 21 | 8 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144539 | 106317 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 823 | 21 | 8 | 8 | 3.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44386117 | 130829 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)/C(=C/c1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
CHEMBL368803 | 130829 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 541 | 9 | 4 | 4 | 5.3 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)/C(=C/c1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80273-5 | ||
44458120 | 98504 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 377 | 5 | 3 | 3 | 2.0 | O=C(N[C@@H]1C(=O)N(Cc2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL279730 | 98504 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 377 | 5 | 3 | 3 | 2.0 | O=C(N[C@@H]1C(=O)N(Cc2ccccc2)C[C@@H]1C(=O)O)c1cc2ccccc2[nH]1 | 10.1016/S0960-894X(00)80224-3 | ||
44366587 | 43445 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 10 | 0 | 8 | 7.2 | CCOP(=O)(OCC)OC1=CCN(Cc2ccccc2)CC1Cc1cn(C(=O)OC(C)(C)C)c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL151022 | 43445 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 10 | 0 | 8 | 7.2 | CCOP(=O)(OCC)OC1=CCN(Cc2ccccc2)CC1Cc1cn(C(=O)OC(C)(C)C)c2ccccc12 | 10.1016/0960-894X(94)80030-8 | ||
CHEMBL441840 | 212149 | 0 | None | - | 0 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
14208246 | 202976 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00120a002 | ||
CHEMBL73892 | 202976 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00120a002 | ||
15637194 | 25734 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 308 | 2 | 2 | 3 | 1.5 | CN1C(=O)C(NC(N)=O)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135405 | 25734 | 0 | None | - | 0 | Rat | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 308 | 2 | 2 | 3 | 1.5 | CN1C(=O)C(NC(N)=O)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44592484 | 187529 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 337 | 5 | 4 | 3 | 2.2 | O=C(O)CNC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL498273 | 187529 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 337 | 5 | 4 | 3 | 2.2 | O=C(O)CNC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
10553207 | 206531 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 492 | 6 | 2 | 6 | 4.7 | CC(C)Oc1cccc(-n2c(NNC(=O)c3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9888 | 206531 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 492 | 6 | 2 | 6 | 4.7 | CC(C)Oc1cccc(-n2c(NNC(=O)c3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
23757281 | 9758 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 539 | 8 | 2 | 5 | 5.5 | CCN(CC)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL114072 | 9758 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 539 | 8 | 2 | 5 | 5.5 | CCN(CC)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
10389643 | 118516 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 462 | 5 | 3 | 4 | 3.8 | O=C(O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL342614 | 118516 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 462 | 5 | 3 | 4 | 3.8 | O=C(O)CN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
9984739 | 114316 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 5 | 3 | 3 | 6.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2C1CCCCC1 | 10.1021/jm00048a015 | ||
CHEMBL334100 | 114316 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 538 | 5 | 3 | 3 | 6.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2C1CCCCC1 | 10.1021/jm00048a015 | ||
44280180 | 102160 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 655 | 11 | 5 | 8 | 3.6 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30430 | 102160 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 655 | 11 | 5 | 8 | 3.6 | CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCSCc3csc(N=C(N)N)n3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00248-X | ||
44329304 | 107632 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 526 | 7 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL319569 | 107632 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 526 | 7 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
44382749 | 59397 | 0 | None | - | 0 | Mouse | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 532 | 11 | 4 | 4 | 3.0 | CC(C)C[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL172354 | 59397 | 0 | None | - | 0 | Mouse | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 532 | 11 | 4 | 4 | 3.0 | CC(C)C[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
10673307 | 110147 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 7 | 3 | 5 | 4.2 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(NC=O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL325746 | 110147 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 7 | 3 | 5 | 4.2 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(NC=O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
14208246 | 202976 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00047a021 | ||
CHEMBL73892 | 202976 | 0 | None | - | 0 | Rat | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00047a021 | ||
44327455 | 106861 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 585 | 12 | 3 | 4 | 6.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL317626 | 106861 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 585 | 12 | 3 | 4 | 6.0 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
15104603 | 9406 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 436 | 13 | 3 | 2 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc[nH]1 | 10.1021/jm00116a002 | ||
CHEMBL112054 | 9406 | 0 | None | - | 0 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 436 | 13 | 3 | 2 | 5.0 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc[nH]1 | 10.1021/jm00116a002 | ||
10412837 | 27416 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 479 | 5 | 3 | 5 | 4.0 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3n[nH]c(C)n3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL136975 | 27416 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 479 | 5 | 3 | 5 | 4.0 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(Cc3n[nH]c(C)n3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL345598 | 209963 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)N(C)C(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
44382562 | 58791 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 662 | 13 | 5 | 5 | 5.8 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccc(O)cc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL169710 | 58791 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 662 | 13 | 5 | 5 | 5.8 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccc(O)cc1)NCCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
10408567 | 118774 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
CHEMBL343767 | 118774 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00078a018 | ||
90663991 | 106337 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 868 | 22 | 8 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144560 | 106337 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 868 | 22 | 8 | 10 | 3.2 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
14991567 | 198118 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 847 | 20 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL59404 | 198118 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 847 | 20 | 8 | 8 | 4.0 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
44280117 | 101581 | 0 | None | - | 0 | Mouse | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 672 | 12 | 3 | 6 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL30195 | 101581 | 0 | None | - | 0 | Mouse | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 672 | 12 | 3 | 6 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
14423345 | 202726 | 1 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 283 | 1 | 1 | 3 | 1.9 | CN1C(=O)C(N)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL72151 | 202726 | 1 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 283 | 1 | 1 | 3 | 1.9 | CN1C(=O)C(N)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10768084 | 9924 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 512 | 6 | 2 | 6 | 4.1 | CN(C)c1cccc(NC(=O)N[C@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL114991 | 9924 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 512 | 6 | 2 | 6 | 4.1 | CN(C)c1cccc(NC(=O)N[C@H]2N=C(c3ccccn3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
44408483 | 168363 | 0 | None | -165 | 4 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.7 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL438739 | 168363 | 0 | None | -165 | 4 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.7 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL262172 | 208783 | 0 | None | -26302 | 4 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
44376112 | 119688 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL351854 | 119688 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
14208221 | 79138 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 530 | 6 | 2 | 5 | 4.2 | CN1C(=O)C(NC(=O)C(Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2114102 | 79138 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 530 | 6 | 2 | 5 | 4.2 | CN1C(=O)C(NC(=O)C(Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
44354128 | 20094 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL130578 | 20094 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
14802521 | 58775 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL169616 | 58775 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
10392523 | 206206 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL96970 | 206206 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
15104609 | 110050 | 0 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1nccc2ccccc12 | 10.1021/jm00116a002 | ||
CHEMBL325160 | 110050 | 0 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1nccc2ccccc12 | 10.1021/jm00116a002 | ||
19766222 | 116102 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 383 | 5 | 1 | 4 | 3.9 | CC(C)COC(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
CHEMBL336690 | 116102 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 383 | 5 | 1 | 4 | 3.9 | CC(C)COC(=O)NCC1CN=C(c2ccccc2F)c2ccccc2N1C | 10.1021/jm00163a069 | ||
14208308 | 67401 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907845 | 67401 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
15167811 | 167328 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 417 | 3 | 0 | 3 | 4.3 | CN1C(=O)C(N(C)C(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL431185 | 167328 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 417 | 3 | 0 | 3 | 4.3 | CN1C(=O)C(N(C)C(=O)c2ccccc2Cl)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
11607292 | 165443 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
CHEMBL425392 | 165443 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1C[C@H]2c3[nH]c4ccccc4c3C[C@H](C(=O)N[C@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
44303526 | 201454 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 708 | 14 | 4 | 6 | 6.3 | O=C(CCC(=O)OCc1ccccc1)N[C@@H](CNC(=O)C(Cc1c[nH]c2ccc(F)cc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL64155 | 201454 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 708 | 14 | 4 | 6 | 6.3 | O=C(CCC(=O)OCc1ccccc1)N[C@@H](CNC(=O)C(Cc1c[nH]c2ccc(F)cc12)NC(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
54582313 | 61591 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc2ccccc2cc1N1CCN(C(=O)c2ncc(-c3ccc(OC)cc3)c(-c3ccc(C)cc3)n2)CC1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774039 | 61591 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 572 | 6 | 0 | 7 | 6.0 | COC(=O)c1cc2ccccc2cc1N1CCN(C(=O)c2ncc(-c3ccc(OC)cc3)c(-c3ccc(C)cc3)n2)CC1 | 10.1016/j.bmcl.2011.03.069 | ||
10744359 | 10062 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 513 | 6 | 2 | 6 | 4.5 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL115833 | 10062 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 513 | 6 | 2 | 6 | 4.5 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
15689724 | 106116 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142696 | 106116 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
44370497 | 164641 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 8 | 3 | 3 | 4.6 | O=C(O)CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1 | 10.1021/jm00164a020 | ||
CHEMBL422873 | 164641 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 8 | 3 | 3 | 4.6 | O=C(O)CC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N(C1CCCCC1)C1CCCCC1 | 10.1021/jm00164a020 | ||
90663256 | 106148 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 854 | 17 | 7 | 8 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CSC(C)(C)[C@H]1C(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||
CHEMBL3143146 | 106148 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 854 | 17 | 7 | 8 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CSC(C)(C)[C@H]1C(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||
155521287 | 170011 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 4.8 | CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)C21 | 10.1021/acs.jmedchem.9b02080 | ||
CHEMBL4450506 | 170011 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 4.8 | CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)C21 | 10.1021/acs.jmedchem.9b02080 | ||
44283081 | 99409 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL2112071 | 99409 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL285880 | 99409 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 500 | 9 | 3 | 3 | 6.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(O)CCCc1ccccc1 | 10.1021/jm00086a017 | ||
14208225 | 67412 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907855 | 67412 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 426 | 3 | 2 | 3 | 3.9 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208204 | 202760 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
CHEMBL72300 | 202760 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00120a002 | ||
14208204 | 202760 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00047a021 | ||
CHEMBL72300 | 202760 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 407 | 3 | 2 | 3 | 4.0 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc(Cl)cc1 | 10.1021/jm00047a021 | ||
44376191 | 164773 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL423472 | 164773 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2ccc(-c3nn[nH]n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
10010890 | 108250 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 874 | 22 | 8 | 8 | 4.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
CHEMBL320858 | 108250 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 874 | 22 | 8 | 8 | 4.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00028a015 | ||
10409534 | 28028 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL137398 | 28028 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
5311205 | 12983 | 1 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL1190319 | 12983 | 1 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL540596 | 12983 | 1 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CC4CCC(CC4)C3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
54583260 | 61544 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773896 | 61544 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 519 | 5 | 0 | 6 | 5.5 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
11039097 | 79136 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 573 | 7 | 3 | 5 | 4.7 | C[C@@H](c1ccccc1)N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
CHEMBL2114084 | 79136 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 573 | 7 | 3 | 5 | 4.7 | C[C@@H](c1ccccc1)N1C(=O)C[C@H]2[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
24785177 | 189189 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1ccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL516113 | 189189 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1ccc(-n2cc(C(=O)N3CCN(c4ccc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL3142697 | 209387 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
44373701 | 52211 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 541 | 8 | 4 | 4 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N/C(=C\c1ccccc1)C(=O)O | 10.1016/S0960-894X(01)81250-6 | ||
CHEMBL159138 | 52211 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 541 | 8 | 4 | 4 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N/C(=C\c1ccccc1)C(=O)O | 10.1016/S0960-894X(01)81250-6 | ||
9978327 | 78406 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 400 | 3 | 3 | 4 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2112753 | 78406 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 400 | 3 | 3 | 4 | 3.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
11765552 | 113131 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNC(=O)CCC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm00017a022 | ||
CHEMBL332263 | 113131 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNC(=O)CCC(=O)O)NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm00017a022 | ||
44300888 | 100324 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 580 | 6 | 4 | 6 | 4.5 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(-c4nn[nH]n4)c3)C(=O)N(CC(=O)NC(C)(C)C)c3cc(C)ccc32)cc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL293107 | 100324 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 580 | 6 | 4 | 6 | 4.5 | Cc1ccc([C@H]2C[C@@H](NC(=O)Nc3cccc(-c4nn[nH]n4)c3)C(=O)N(CC(=O)NC(C)(C)C)c3cc(C)ccc32)cc1 | 10.1016/0960-894X(95)00327-P | ||
44348808 | 17753 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 451 | 7 | 3 | 4 | 3.9 | O=C(O)CCC(NC(=O)c1ccc2ccccc2c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL125925 | 17753 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 451 | 7 | 3 | 4 | 3.9 | O=C(O)CCC(NC(=O)c1ccc2ccccc2c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
71456207 | 78214 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 655 | 12 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1c[nH]nn1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112331 | 78214 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 655 | 12 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1c[nH]nn1)c1ccccc1 | 10.1021/jm00092a007 | ||
9853654 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00092a007 | ||
CHEMBL1328 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00092a007 | ||
9853654 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a062 | ||
CHEMBL1328 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00105a062 | ||
15104627 | 109989 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 462 | 7 | 2 | 3 | 4.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL324760 | 109989 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 462 | 7 | 2 | 3 | 4.7 | CN(Cc1ccccc1)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
9853654 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00057a005 | ||
CHEMBL1328 | 22588 | 37 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00057a005 | ||
44360121 | 116245 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 417 | 5 | 2 | 4 | 3.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(O)c1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL337530 | 116245 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 417 | 5 | 2 | 4 | 3.3 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)C(O)c1ccccc1 | 10.1021/jm00163a069 | ||
11742520 | 29413 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1ccccc1NC(=O)NC1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00078a018 | ||
CHEMBL138592 | 29413 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1ccccc1NC(=O)NC1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00078a018 | ||
10431936 | 92806 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL2448131 | 92806 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 414 | 4 | 2 | 4 | 3.7 | COc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
14208198 | 103899 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 537 | 6 | 4 | 5 | 4.5 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
CHEMBL310246 | 103899 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 537 | 6 | 4 | 5 | 4.5 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O | 10.1021/jm00120a002 | ||
44349410 | 16598 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 394 | 7 | 3 | 3 | 3.5 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCCC1 | 10.1021/jm00079a003 | ||
CHEMBL124459 | 16598 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 394 | 7 | 3 | 3 | 3.5 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCCC1 | 10.1021/jm00079a003 | ||
15556550 | 67381 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 326 | 3 | 1 | 2 | 4.5 | CC(C)C[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O | 10.1021/jm00390a019 | ||
CHEMBL1907736 | 67381 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 326 | 3 | 1 | 2 | 4.5 | CC(C)C[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O | 10.1021/jm00390a019 | ||
11571172 | 140054 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
CHEMBL381347 | 140054 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
19018661 | 28271 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 442 | 5 | 3 | 4 | 3.3 | CN1C(=O)C(NC(=O)Nc2cccc(CC(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137567 | 28271 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 442 | 5 | 3 | 4 | 3.3 | CN1C(=O)C(NC(=O)Nc2cccc(CC(=O)O)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10000984 | 116143 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3cnccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL336972 | 116143 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3cnccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
10392523 | 206206 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL96970 | 206206 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
44280996 | 99283 | 0 | None | - | 1 | Mouse | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 745 | 14 | 4 | 8 | 5.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL284976 | 99283 | 0 | None | - | 1 | Mouse | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 745 | 14 | 4 | 8 | 5.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
15614737 | 75582 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 410 | 3 | 1 | 2 | 5.9 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1Cc1ccc2ccccc2c1 | 10.1021/jm00390a019 | ||
CHEMBL20514 | 75582 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 410 | 3 | 1 | 2 | 5.9 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1Cc1ccc2ccccc2c1 | 10.1021/jm00390a019 | ||
44303299 | 199566 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 598 | 11 | 4 | 6 | 5.5 | CC(Cc1ccc(Oc2ccccc2)cc1)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)[C@H](O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL60386 | 199566 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 598 | 11 | 4 | 6 | 5.5 | CC(Cc1ccc(Oc2ccccc2)cc1)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)[C@H](O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
14208298 | 202927 | 1 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL73511 | 202927 | 1 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)C(NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
44210425 | 164742 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 439 | 5 | 2 | 5 | 3.5 | COc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL423278 | 164742 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 439 | 5 | 2 | 5 | 3.5 | COc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)OC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
9960703 | 167475 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 621 | 6 | 3 | 7 | 4.0 | O=C(Nc1cccc(-c2nn[nH]n2)c1)NC1N=C(c2ccccc2F)c2ccccc2N(CC(=O)N2CC3CCC(CC3)C2)C1=O | 10.1016/s0960-894x(98)00237-6 | ||
CHEMBL432266 | 167475 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 621 | 6 | 3 | 7 | 4.0 | O=C(Nc1cccc(-c2nn[nH]n2)c1)NC1N=C(c2ccccc2F)c2ccccc2N(CC(=O)N2CC3CCC(CC3)C2)C1=O | 10.1016/s0960-894x(98)00237-6 | ||
44287087 | 99998 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 796 | 19 | 7 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL290719 | 99998 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 796 | 19 | 7 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
44458113 | 167612 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 392 | 4 | 2 | 3 | 2.8 | O=C(N[C@@H]1C(=O)N(c2ccccc2F)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
CHEMBL433222 | 167612 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 392 | 4 | 2 | 3 | 2.8 | O=C(N[C@@H]1C(=O)N(c2ccccc2F)C[C@@H]1C(=O)O)c1ccc2ccccc2c1 | 10.1016/S0960-894X(00)80224-3 | ||
9872735 | 186444 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 567 | 5 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3ccccc3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL49085 | 186444 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 567 | 5 | 2 | 4 | 5.1 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3ccccc3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
44300852 | 101501 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 566 | 6 | 4 | 6 | 4.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL301418 | 101501 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 566 | 6 | 4 | 6 | 4.1 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(-c3nn[nH]n3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
71458004 | 78218 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 670 | 12 | 5 | 8 | 4.7 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCn1nn[nH]c1=S)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112335 | 78218 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 670 | 12 | 5 | 8 | 4.7 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCn1nn[nH]c1=S)c1ccccc1 | 10.1021/jm00092a007 | ||
10323690 | 100032 | 0 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2114401 | 100032 | 0 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL291033 | 100032 | 0 | None | - | 2 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
14208299 | 67400 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907844 | 67400 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@@H](NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10416987 | 12103 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 539 | 5 | 2 | 4 | 3.2 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CC[N+](C)(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL1184312 | 12103 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 539 | 5 | 2 | 4 | 3.2 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CC[N+](C)(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL343949 | 12103 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 539 | 5 | 2 | 4 | 3.2 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CC[N+](C)(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
11607291 | 170451 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
CHEMBL445662 | 170451 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
44368594 | 120538 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 447 | 8 | 3 | 3 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL356810 | 120538 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 447 | 8 | 3 | 3 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
44349073 | 16380 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 395 | 7 | 3 | 4 | 2.5 | CC1(C)CCN(NC(=O)C(CCC(=O)O)NC(=O)c2cccc(Cl)c2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL123785 | 16380 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 395 | 7 | 3 | 4 | 2.5 | CC1(C)CCN(NC(=O)C(CCC(=O)O)NC(=O)c2cccc(Cl)c2)CC1 | 10.1021/jm00079a003 | ||
11124446 | 78027 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
CHEMBL2111552 | 78027 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 545 | 6 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(c3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010813d | ||
14519981 | 9965 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00124a003 | ||
CHEMBL115269 | 9965 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00124a003 | ||
14519981 | 9965 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00116a002 | ||
CHEMBL115269 | 9965 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 441 | 14 | 2 | 4 | 4.4 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc2ccccc2n1 | 10.1021/jm00116a002 | ||
44370694 | 47746 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL155017 | 47746 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 488 | 15 | 2 | 4 | 4.8 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)N1CCCC1)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
10348659 | 1774 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 10.1021/jm950626d | ||
866 | 1774 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 10.1021/jm950626d | ||
CHEMBL1184355 | 1774 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 604 | 8 | 2 | 5 | 5.4 | O=C(NC1C(=O)N(c2ccccc2)c2c(N(C1=O)CC(=O)N(c1ccc(cc1)N(C)C)C(C)C)cccc2)Nc1ccccc1 | 10.1021/jm950626d | ||
44306887 | 101591 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL302027 | 101591 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 816 | 18 | 9 | 7 | 3.4 | CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC(Cc1cccc(NC(=O)Nc2ccccc2C)c1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(C)cc1)C(N)=O | 10.1021/jm00001a027 | ||
CHEMBL355778 | 209993 | 0 | None | - | 0 | Mouse | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@H](CCc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
19910130 | 119286 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 439 | 14 | 3 | 3 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL348168 | 119286 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 439 | 14 | 3 | 3 | 4.9 | CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
44578398 | 181202 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc5ccccc45)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL477784 | 181202 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 502 | 5 | 0 | 5 | 6.0 | COc1cccc(-n2cc(C(=O)N3CCN(c4cccc5ccccc45)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL172177 | 207108 | 0 | None | - | 0 | Mouse | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@@H](Cc2ccccc2)NC(=O)[C@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
44349064 | 16343 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 7 | 3 | 4 | 3.4 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
CHEMBL123684 | 16343 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 7 | 3 | 4 | 3.4 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NN1CCC2(CCCCC2)CC1 | 10.1021/jm00079a003 | ||
15167820 | 67372 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 393 | 3 | 0 | 3 | 4.6 | CN1C(=O)[C@@H](Cc2cn(C)c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907724 | 67372 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 393 | 3 | 0 | 3 | 4.6 | CN1C(=O)[C@@H](Cc2cn(C)c3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00390a019 | ||
44327699 | 205749 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 641 | 15 | 2 | 5 | 7.2 | COC(=O)CCCCCCN(CCc1ccccc1)C(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL94352 | 205749 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 641 | 15 | 2 | 5 | 7.2 | COC(=O)CCCCCCN(CCc1ccccc1)C(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1016/S0960-894X(01)80769-1 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44283086 | 118829 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 482 | 8 | 2 | 2 | 7.2 | CC(/C=C/CCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL34422 | 118829 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 482 | 8 | 2 | 2 | 7.2 | CC(/C=C/CCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
10008405 | 118285 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL342110 | 118285 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL169174 | 207093 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 | 10.1016/S0960-894X(01)80253-5 | ||||
44333997 | 108272 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 588 | 10 | 3 | 5 | 5.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL320886 | 108272 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 588 | 10 | 3 | 5 | 5.3 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/0960-894X(95)00537-3 | ||
10551234 | 96493 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 443 | 6 | 3 | 6 | 4.6 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL266120 | 96493 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 443 | 6 | 3 | 6 | 4.6 | Cc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
6956374 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
902 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
CHEMBL117281 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm000937a | ||
6956374 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
902 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL117281 | 2373 | 4 | None | - | 1 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
2118 | 201792 | 35 | None | - | 2 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | 10.1021/jm00396a028 | ||
CHEMBL661 | 201792 | 35 | None | - | 2 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | 10.1021/jm00396a028 | ||
CHEMBL2372078 | 208439 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](CCCNCc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
CHEMBL383458 | 210566 | 0 | None | -10 | 4 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
10409900 | 103381 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 420 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@@H](N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00234-K | ||
CHEMBL30919 | 103381 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 420 | 3 | 2 | 3 | 4.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@@H](N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00234-K | ||
44318205 | 204080 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 459 | 3 | 3 | 4 | 3.9 | CN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)CCC3)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
CHEMBL83130 | 204080 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 459 | 3 | 3 | 4 | 3.9 | CN1C(=O)[C@H](NC(=O)Nc2ccc3c(c2)CCC3)N=C([C@H]2CC(C)(C)CCN2)c2ccccc21 | 10.1021/jm9608523 | ||
44303515 | 101623 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 571 | 9 | 2 | 5 | 5.3 | CN(C)C(=O)c1oc2ccccc2c1CC(C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL302194 | 101623 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 571 | 9 | 2 | 5 | 5.3 | CN(C)C(=O)c1oc2ccccc2c1CC(C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
10363545 | 204027 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL82685 | 204027 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
10363545 | 204027 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL82685 | 204027 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 2 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
90663984 | 106331 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 841 | 21 | 8 | 8 | 3.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144553 | 106331 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 841 | 21 | 8 | 8 | 3.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(F)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
118719193 | 114959 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 3.6 | CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
CHEMBL3350871 | 114959 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 520 | 7 | 2 | 5 | 3.6 | CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm991078x | ||
CHEMBL3142685 | 209382 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
10413618 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/s0960-894x(00)00198-0 | ||
CHEMBL62205 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/s0960-894x(00)00198-0 | ||
9983419 | 108899 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL321946 | 108899 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00105a062 | ||
10413618 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL62205 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
44280200 | 100357 | 0 | None | - | 1 | Mouse | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 785 | 18 | 4 | 7 | 6.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL29331 | 100357 | 0 | None | - | 1 | Mouse | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 785 | 18 | 4 | 7 | 6.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
10413618 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL62205 | 201103 | 0 | None | - | 1 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1021/jm970065l | ||
15719750 | 78074 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 446 | 9 | 3 | 3 | 4.0 | O=C(O)CC[C@H](NC(=O)c1cccc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
CHEMBL2111825 | 78074 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 446 | 9 | 3 | 3 | 4.0 | O=C(O)CC[C@H](NC(=O)c1cccc(Cl)c1)C(=O)NCCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00079a003 | ||
13605417 | 205834 | 3 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00124a003 | ||
54581301 | 61590 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 5 | 1 | 5 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5cc[nH]c5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774038 | 61590 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 5 | 1 | 5 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5cc[nH]c5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
15167812 | 101726 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 3.6 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)[N+]([O-])=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL302825 | 101726 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 437 | 3 | 1 | 3 | 3.6 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)[N+]([O-])=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
13605417 | 205834 | 3 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
44368382 | 45084 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL152682 | 45084 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 511 | 9 | 4 | 4 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1CCCCC1Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10480792 | 45543 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL153095 | 45543 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3350686 | 45543 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
136242438 | 78216 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 671 | 12 | 6 | 7 | 4.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1n[nH]c(=O)[nH]1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112333 | 78216 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 671 | 12 | 6 | 7 | 4.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1n[nH]c(=O)[nH]1)c1ccccc1 | 10.1021/jm00092a007 | ||
10699165 | 110965 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 625 | 7 | 1 | 4 | 6.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(C(F)(F)F)cc1 | 10.1021/jm970265x | ||
CHEMBL327552 | 110965 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 625 | 7 | 1 | 4 | 6.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccc(C(F)(F)F)cc1 | 10.1021/jm970265x | ||
44211352 | 13872 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL1196916 | 13872 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
CHEMBL558614 | 13872 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 3.8 | CN1CCN(C(=O)CCC(NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)N2CCC3(CCCC3)CC2)CC1 | 10.1016/S0960-894X(00)80681-2 | ||
11744065 | 78403 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.6 | CC(=O)Oc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL2112750 | 78403 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 442 | 4 | 2 | 5 | 3.6 | CC(=O)Oc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
15167809 | 67373 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 440 | 5 | 2 | 3 | 3.6 | NC(=O)CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL1907725 | 67373 | 0 | None | - | 0 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 440 | 5 | 2 | 3 | 3.6 | NC(=O)CN1C(=O)[C@@H](Cc2c[nH]c3ccccc23)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00390a019 | ||
135703408 | 142304 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 511 | 4 | 2 | 6 | 6.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(O)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL389311 | 142304 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 511 | 4 | 2 | 6 | 6.0 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccc(O)cc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
44349254 | 16654 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 354 | 10 | 3 | 3 | 2.6 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL124751 | 16654 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 354 | 10 | 3 | 3 | 2.6 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
23129945 | 9519 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 604 | 16 | 2 | 4 | 7.8 | CCCCCN(CCCCC)C(=O)C(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
CHEMBL112612 | 9519 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 604 | 16 | 2 | 4 | 7.8 | CCCCCN(CCCCC)C(=O)C(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)NC(=O)c1cnc2ccccc2c1 | 10.1021/jm00116a002 | ||
14888721 | 76884 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 1055 | 30 | 11 | 14 | -0.2 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(Cc2nnn[nH]2)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL2079551 | 76884 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 1055 | 30 | 11 | 14 | -0.2 | CSCC[C@H](NC(=O)[C@H](Cc1ccc(Cc2nnn[nH]2)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00107a037 | ||
CHEMBL350222 | 209976 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)N(C)CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||||
22354599 | 193137 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 517 | 6 | 2 | 5 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccncc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL538912 | 193137 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 517 | 6 | 2 | 5 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccncc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
15104600 | 96639 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
CHEMBL267339 | 96639 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 515 | 13 | 2 | 2 | 7.0 | CCCCCN(CCCCC)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00116a002 | ||
10484212 | 99417 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL285921 | 99417 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
45482488 | 196628 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1cccc2cc(C(=O)Nc3ccccc3C(=O)NC(Cc3ccccc3)C(=O)O)[nH]c12 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL576021 | 196628 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 441 | 7 | 4 | 3 | 4.2 | Cc1cccc2cc(C(=O)Nc3ccccc3C(=O)NC(Cc3ccccc3)C(=O)O)[nH]c12 | 10.1016/j.bmc.2009.05.067 | ||
44327458 | 206121 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
CHEMBL96469 | 206121 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1016/S0960-894X(01)80769-1 | ||
44379965 | 57533 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 496 | 6 | 2 | 5 | 5.5 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(C(F)(F)F)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL167169 | 57533 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 496 | 6 | 2 | 5 | 5.5 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(C(F)(F)F)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
44349335 | 116810 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 401 | 7 | 3 | 4 | 2.6 | Cc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
CHEMBL339707 | 116810 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 401 | 7 | 3 | 4 | 2.6 | Cc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10252366 | 25680 | 11 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 434 | 3 | 2 | 3 | 4.8 | CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135364 | 25680 | 11 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 434 | 3 | 2 | 3 | 4.8 | CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10649606 | 49349 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL156605 | 49349 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 6 | 3 | 4 | 4.5 | O=C(CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)Nc1ccccc1 | 10.1016/j.bmcl.2015.03.051 | ||
70683295 | 73249 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 606 | 7 | 1 | 5 | 6.2 | O=C(CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21)N1CCC(Cc2ccccc2)C1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017692 | 73249 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 606 | 7 | 1 | 5 | 6.2 | O=C(CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21)N1CCC(Cc2ccccc2)C1 | 10.1016/j.bmcl.2012.02.049 | ||
73355866 | 204509 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 13 | 5 | 6 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNS(=O)(=O)C(F)(F)F)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL86702 | 204509 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 13 | 5 | 6 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNS(=O)(=O)C(F)(F)F)c1ccccc1 | 10.1021/jm00092a007 | ||
71454457 | 78213 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 655 | 12 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112330 | 78213 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 655 | 12 | 5 | 7 | 4.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CSc1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
44370393 | 119139 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 492 | 14 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCCC1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL346784 | 119139 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 492 | 14 | 2 | 3 | 5.4 | CCCCCN(CCCCC)C(=O)C(CCC(=O)N1CCCC1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
15673149 | 85565 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 13 | 5 | 6 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCNS(=O)(=O)C(F)(F)F)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304151 | 85565 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 717 | 13 | 5 | 6 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCNS(=O)(=O)C(F)(F)F)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
44349412 | 16686 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 396 | 12 | 3 | 3 | 3.6 | CCCCC(CC)CNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL124917 | 16686 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 396 | 12 | 3 | 3 | 3.6 | CCCCC(CC)CNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
10361419 | 26249 | 11 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 364 | 2 | 2 | 3 | 2.9 | CN1C(=O)C(NC(=O)NC(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL135988 | 26249 | 11 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 364 | 2 | 2 | 3 | 2.9 | CN1C(=O)C(NC(=O)NC(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44303243 | 201236 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 545 | 9 | 5 | 5 | 4.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)[C@H](O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL62832 | 201236 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 545 | 9 | 5 | 5 | 4.2 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)[C@H](O)c1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
10507071 | 113111 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
CHEMBL332261 | 113111 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm0501127 | ||
10553685 | 118646 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 508 | 8 | 3 | 5 | 4.2 | COC[C@@H]1CCCN1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
CHEMBL342907 | 118646 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 508 | 8 | 3 | 5 | 4.2 | COC[C@@H]1CCCN1NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm970065l | ||
9985100 | 114004 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2cccc(Cl)c2)c2ccccc21 | 10.1021/jm00048a015 | ||
CHEMBL333541 | 114004 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 552 | 5 | 3 | 3 | 6.0 | CC(C)(C)NC(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(Cl)c2)C[C@H](c2cccc(Cl)c2)c2ccccc21 | 10.1021/jm00048a015 | ||
44368611 | 121480 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 541 | 10 | 4 | 3 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL359292 | 121480 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 541 | 10 | 4 | 3 | 4.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
14208273 | 67396 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 457 | 7 | 1 | 3 | 5.1 | CCCCCc1ccc(C(=O)N[C@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL1907840 | 67396 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 457 | 7 | 1 | 3 | 5.1 | CCCCCc1ccc(C(=O)N[C@H]2N=C(c3ccccc3F)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00120a002 | ||
44334172 | 4501 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 556 | 10 | 3 | 5 | 4.9 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL102526 | 4501 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 556 | 10 | 3 | 5 | 4.9 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44379640 | 57282 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 522 | 6 | 2 | 5 | 5.8 | CC(C)Oc1cccc(-n2c(C/N=C(\S)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL166737 | 57282 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 522 | 6 | 2 | 5 | 5.8 | CC(C)Oc1cccc(-n2c(C/N=C(\S)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
44303470 | 201574 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 479 | 8 | 2 | 5 | 4.5 | Cc1noc(C)c1CC(C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL64623 | 201574 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 479 | 8 | 2 | 5 | 4.5 | Cc1noc(C)c1CC(C)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL2372079 | 208440 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](CCNCc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
44286836 | 161176 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 810 | 19 | 6 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL41364 | 161176 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 810 | 19 | 6 | 7 | 4.8 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CCC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
15692562 | 109148 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 473 | 14 | 4 | 6 | 3.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc(O)c2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
CHEMBL322284 | 109148 | 0 | None | - | 0 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 473 | 14 | 4 | 6 | 3.8 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc(O)c2cccc(O)c2n1 | 10.1021/jm00116a002 | ||
10700916 | 173864 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4553223 | 173864 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2310858 | 207745 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CCCC1CCN([C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc2ccccc2)C(N)=O)[C@H]1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CCc1ccc(OS(=O)(=O)O)cc1 | 10.1021/jm00094a001 | ||||
44293999 | 187841 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 597 | 6 | 2 | 5 | 5.1 | COc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL50216 | 187841 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 597 | 6 | 2 | 5 | 5.1 | COc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3cccc(C)c3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1 | 10.1016/S0960-894X(96)00609-9 | ||
9985667 | 162809 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
CHEMBL419237 | 162809 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
44293811 | 184536 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 5 | 2 | 4 | 5.8 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(Cl)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL48563 | 184536 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 601 | 5 | 2 | 4 | 5.8 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(Cl)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
9985667 | 162809 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL419237 | 162809 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
14590302 | 100968 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 444 | 4 | 1 | 4 | 4.3 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)c2ccc3ccccc3c2)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL297534 | 100968 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 444 | 4 | 1 | 4 | 4.3 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)c2ccc3ccccc3c2)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
367893 | 51344 | 1 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL158362 | 51344 | 1 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 429 | 14 | 3 | 3 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
10048986 | 27347 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 442 | 5 | 3 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL136919 | 27347 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 442 | 5 | 3 | 4 | 3.4 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
10816889 | 78430 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 570 | 8 | 3 | 6 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@H](C#N)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
CHEMBL2112824 | 78430 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 570 | 8 | 3 | 6 | 4.5 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@H](C#N)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm991078x | ||
136046102 | 100210 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 864 | 20 | 9 | 10 | 3.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cnc2cccc(O)c2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL292298 | 100210 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 864 | 20 | 9 | 10 | 3.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c1cnc2cccc(O)c2c1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
11742839 | 12715 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL1188361 | 12715 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL536245 | 12715 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 419 | 2 | 2 | 4 | 3.7 | Cc1cccc(NC(=O)N[C@H]2N=C(N3CCCCCC3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
15514020 | 78181 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 7 | 3 | 7 | 4.0 | CC(=O)Oc1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
CHEMBL2112232 | 78181 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 603 | 7 | 3 | 7 | 4.0 | CC(=O)Oc1cccc(N2C(=O)C[C@H]3[C@H](NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)CCCN3C2=O)c1 | 10.1021/jm010813d | ||
14208234 | 202993 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 3 | 4 | 4 | 3.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(O)ccc2[nH]1 | 10.1021/jm00047a021 | ||
CHEMBL74066 | 202993 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 3 | 4 | 4 | 3.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(O)ccc2[nH]1 | 10.1021/jm00047a021 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
14208270 | 67410 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907853 | 67410 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 447 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@H](NC(=O)c2ccc(Br)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
13809511 | 101824 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 512 | 6 | 2 | 5 | 4.1 | CN1C(=O)C(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL303386 | 101824 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 512 | 6 | 2 | 5 | 4.1 | CN1C(=O)C(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
15060278 | 120285 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 633 | 12 | 3 | 5 | 6.5 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)OCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL355532 | 120285 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 633 | 12 | 3 | 5 | 6.5 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)OCc1ccccc1 | 10.1016/S0960-894X(00)80687-3 | ||
44329287 | 205901 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccc(F)cc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL95209 | 205901 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 544 | 6 | 3 | 3 | 5.7 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccc(F)cc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
10815039 | 112349 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 493 | 5 | 2 | 5 | 4.5 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL330917 | 112349 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 493 | 5 | 2 | 5 | 4.5 | CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
15614750 | 118818 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 426 | 4 | 3 | 3 | 3.9 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
CHEMBL344154 | 118818 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 426 | 4 | 3 | 3 | 3.9 | O=C(NCC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2[nH]1 | 10.1021/jm00163a069 | ||
10744557 | 32507 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 521 | 7 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1C(=O)O | 10.1021/jm970065l | ||
CHEMBL141370 | 32507 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 521 | 7 | 4 | 4 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC1CCCCC1C(=O)O | 10.1021/jm970065l | ||
44372047 | 156588 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 854 | 20 | 7 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)N(C)C(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
CHEMBL407507 | 156588 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 854 | 20 | 7 | 8 | 4.2 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)N(C)C(=O)OC(C)(C)C)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00031a013 | ||
16100410 | 141266 | 0 | None | -6309 | 4 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL386212 | 141266 | 0 | None | -6309 | 4 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
11803746 | 106131 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||
CHEMBL3142904 | 106131 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 870 | 21 | 9 | 10 | 3.0 | COC(=O)c1ccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm960509y | ||
14208230 | 102734 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 446 | 3 | 3 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL308414 | 102734 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 446 | 3 | 3 | 3 | 4.5 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1 | 10.1021/jm00120a002 | ||
14208234 | 202993 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 3 | 4 | 4 | 3.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(O)ccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL74066 | 202993 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 3 | 4 | 4 | 3.6 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2cc(O)ccc2[nH]1 | 10.1021/jm00120a002 | ||
10053201 | 16415 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 6 | 3 | 3 | 5.9 | CCc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL124004 | 16415 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 546 | 6 | 3 | 3 | 5.9 | CCc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
90663986 | 106333 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 857 | 21 | 8 | 8 | 3.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144555 | 106333 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 857 | 21 | 8 | 8 | 3.9 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C\c1ccc(Cl)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
90663994 | 106340 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 837 | 21 | 8 | 8 | 3.6 | Cc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
CHEMBL3144563 | 106340 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 837 | 21 | 8 | 8 | 3.6 | Cc1ccc(/C=C\C(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 | 10.1021/jm00089a010 | ||
44283030 | 99194 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 629 | 12 | 3 | 7 | 5.4 | COC(=O)CCC(=O)N[C@H](COC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)c1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL284361 | 99194 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 629 | 12 | 3 | 7 | 5.4 | COC(=O)CCC(=O)N[C@H](COC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)c1ccccc1 | 10.1021/jm00086a017 | ||
11607229 | 139907 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
CHEMBL380922 | 139907 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)[C@@H](NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm049072h | ||
44370451 | 50518 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL157658 | 50518 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
19754255 | 58798 | 1 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 340 | 2 | 2 | 3 | 4.4 | Cn1c(C(=O)Nc2cc3c4ccccc4nc-3c[nH]2)cc2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL169767 | 58798 | 1 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 340 | 2 | 2 | 3 | 4.4 | Cn1c(C(=O)Nc2cc3c4ccccc4nc-3c[nH]2)cc2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
10094721 | 205167 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 439 | 5 | 3 | 7 | 3.5 | CN(C)c1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9083 | 205167 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 439 | 5 | 3 | 7 | 3.5 | CN(C)c1cccc(-n2c(NNC(=O)Nc3cccc(C#N)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
19754256 | 59294 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 287 | 2 | 2 | 2 | 3.9 | O=C(Nc1cc2c3ccccc3nc-2c[nH]1)c1ccccc1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL171940 | 59294 | 0 | None | - | 0 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 287 | 2 | 2 | 2 | 3.9 | O=C(Nc1cc2c3ccccc3nc-2c[nH]1)c1ccccc1 | 10.1016/S0960-894X(00)80682-4 | ||
10325557 | 46245 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 563 | 9 | 4 | 4 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@@H]3C[C@@H](C[C@@H](C3)C1)C2Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL153760 | 46245 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 563 | 9 | 4 | 4 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@@H]3C[C@@H](C[C@@H](C3)C1)C2Cl)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
53465907 | 69070 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.7 | O=C(Nc1ccccc1NC(=O)C(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933109 | 69070 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.7 | O=C(Nc1ccccc1NC(=O)C(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
44381830 | 59024 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@H](N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
CHEMBL170664 | 59024 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 610 | 15 | 6 | 7 | 2.5 | N#C[C@H](N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1 | 10.1016/S0960-894X(97)00107-8 | ||
10051647 | 116782 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2C(C)C | 10.1021/jm00048a015 | ||
CHEMBL339547 | 116782 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 498 | 5 | 3 | 3 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2C(C)C | 10.1021/jm00048a015 | ||
21842400 | 120461 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 496 | 7 | 2 | 4 | 5.3 | CCC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(95)00556-9 | ||
CHEMBL356191 | 120461 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 496 | 7 | 2 | 4 | 5.3 | CCC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(95)00556-9 | ||
10816869 | 51576 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 569 | 8 | 3 | 5 | 5.2 | COC(=O)[C@]1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
CHEMBL158547 | 51576 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 569 | 8 | 3 | 5 | 5.2 | COC(=O)[C@]1(NC(=O)[C@@](C)(Cc2c[nH]c3ccccc23)NC(=O)OC2C3CC4CC(C3)CC2C4)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
20063261 | 22923 | 12 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.3 | Cc1cc(C)cc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL133087 | 22923 | 12 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 412 | 3 | 2 | 3 | 4.3 | Cc1cc(C)cc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
44280713 | 99570 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 740 | 15 | 6 | 9 | 3.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL286907 | 99570 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 740 | 15 | 6 | 9 | 3.6 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44382486 | 59108 | 0 | None | - | 0 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 518 | 11 | 4 | 4 | 2.8 | CCCC[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL171051 | 59108 | 0 | None | - | 0 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 518 | 11 | 4 | 4 | 2.8 | CCCC[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||
CHEMBL2372081 | 208442 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
44303650 | 100312 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 6 | 2 | 3 | 6.4 | O=C(NC1(C(=O)NCCc2ccccc2)CC2(Cc3cccc4cccc(c34)C2)C1)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(97)00356-9 | ||
CHEMBL292956 | 100312 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 548 | 6 | 2 | 3 | 6.4 | O=C(NC1(C(=O)NCCc2ccccc2)CC2(Cc3cccc4cccc(c34)C2)C1)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(97)00356-9 | ||
44349354 | 118046 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 415 | 8 | 3 | 4 | 2.9 | CCc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
CHEMBL341505 | 118046 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 415 | 8 | 3 | 4 | 2.9 | CCc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
14208267 | 202821 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 380 | 3 | 2 | 4 | 3.1 | N#Cc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL72710 | 202821 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 380 | 3 | 2 | 4 | 3.1 | N#Cc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
10350069 | 9879 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNC(=O)CCC(=O)O)NC(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm00017a022 | ||
CHEMBL114774 | 9879 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 742 | 17 | 7 | 6 | 5.8 | Cc1ccccc1NC(=O)NCCCC[C@@H](CNC(=O)CCC(=O)O)NC(=O)[C@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 | 10.1021/jm00017a022 | ||
44348902 | 155221 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 1000 | 24 | 11 | 11 | 2.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)ccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
CHEMBL405805 | 155221 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 1000 | 24 | 11 | 11 | 2.3 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(NC(=O)[C@H](Cc2ccc(S(=O)(=O)O)cc2)NC(=O)O)ccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00099a005 | ||
44300862 | 157330 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 695 | 9 | 4 | 6 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)Cc3ccccc3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL408392 | 157330 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 695 | 9 | 4 | 6 | 5.2 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(=O)(=O)Cc3ccccc3)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
14208267 | 202821 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 380 | 3 | 2 | 4 | 3.1 | N#Cc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL72710 | 202821 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 380 | 3 | 2 | 4 | 3.1 | N#Cc1ccc(C(=O)NC2N=C(c3ccccc3)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
10761732 | 75593 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 371 | 4 | 3 | 5 | 3.5 | O=C(NNc1nc2ccccc2c(=O)n1-c1ccccc1)Nc1ccccc1 | 10.1021/jm970373j | ||
CHEMBL2051984 | 75593 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 371 | 4 | 3 | 5 | 3.5 | O=C(NNc1nc2ccccc2c(=O)n1-c1ccccc1)Nc1ccccc1 | 10.1021/jm970373j | ||
44349314 | 16390 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 402 | 8 | 3 | 3 | 3.5 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL123852 | 16390 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 402 | 8 | 3 | 3 | 3.5 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/jm00079a003 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00032a002 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00530-0 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80987-2 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9506736 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9506736 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm9608523 | ||
44376130 | 56043 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00032a003 | ||
CHEMBL163049 | 56043 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1ccc(NC(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1 | 10.1021/jm00032a003 | ||
44280599 | 98705 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 694 | 12 | 4 | 5 | 6.2 | O=C(O)CC[C@H](NC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)C(=O)Nc1cccc2ccccc12 | 10.1021/jm950372w | ||
CHEMBL281206 | 98705 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 694 | 12 | 4 | 5 | 6.2 | O=C(O)CC[C@H](NC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1)C(=O)Nc1cccc2ccccc12 | 10.1021/jm950372w | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm970373j | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm970373j | ||
14802510 | 114619 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 629 | 13 | 4 | 6 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](COC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL334346 | 114619 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 629 | 13 | 4 | 6 | 5.2 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](COC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
44368298 | 120515 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 613 | 13 | 4 | 5 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](COC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL356599 | 120515 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 613 | 13 | 4 | 5 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](COC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
43811299 | 116160 | 11 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 4.7 | CN1C(=O)C(NC(=O)Nc2cccc(C(F)(F)F)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL337055 | 116160 | 11 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 452 | 3 | 2 | 3 | 4.7 | CN1C(=O)C(NC(=O)Nc2cccc(C(F)(F)F)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00078a018 | ||
44281205 | 114320 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 857 | 17 | 4 | 10 | 5.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCN3CCN(C(=O)CNCCCOc4cccc(CN5CCCCC5)c4)CC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL33412 | 114320 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 857 | 17 | 4 | 10 | 5.1 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCN3CCN(C(=O)CNCCCOc4cccc(CN5CCCCC5)c4)CC3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
90663256 | 106148 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 854 | 17 | 7 | 8 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CSC(C)(C)[C@H]1C(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||
CHEMBL3143146 | 106148 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 854 | 17 | 7 | 8 | 5.3 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CSC(C)(C)[C@H]1C(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||
CHEMBL2372080 | 208441 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H]1CNC(=O)CNC(=O)[C@H](CNCc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O | 10.1016/j.bmc.2007.05.067 | ||||
10504136 | 204912 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
CHEMBL8922 | 204912 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 459 | 7 | 3 | 7 | 4.3 | COc1cccc(NC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(OC(C)C)c2)c1 | 10.1021/jm970373j | ||
44286835 | 99821 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 796 | 20 | 8 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL289036 | 99821 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 796 | 20 | 8 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCCCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
9916170 | 76200 | 2 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 575 | 10 | 4 | 4 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccc(F)cc1 | 10.1016/s0960-894x(00)00198-0 | ||
CHEMBL2062146 | 76200 | 2 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 575 | 10 | 4 | 4 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CC(=O)O)Cc1ccc(F)cc1 | 10.1016/s0960-894x(00)00198-0 | ||
10462874 | 98380 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 766 | 16 | 6 | 5 | 7.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCCNC(=O)Nc1ccccc1Cl | 10.1016/S0960-894X(00)80687-3 | ||
CHEMBL278780 | 98380 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 766 | 16 | 6 | 5 | 7.1 | O=C(CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1)NCCCCNC(=O)Nc1ccccc1Cl | 10.1016/S0960-894X(00)80687-3 | ||
10074366 | 120087 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3349028 | 120087 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3545866 | 120087 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | C[C@H]1CCCC[C@@H]1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
10031013 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
CHEMBL88239 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
10031013 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
CHEMBL88239 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960205b | ||
10031013 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
CHEMBL88239 | 204758 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 574 | 8 | 1 | 4 | 6.2 | CC(C)N(C(=O)CN1C(=O)C(C)(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/acs.jmedchem.0c00829 | ||
44286655 | 99394 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 808 | 16 | 6 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(=O)N(C(Cc2ccccc2)C(N)=O)CC1 | 10.1021/jm00037a005 | ||
CHEMBL285772 | 99394 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 808 | 16 | 6 | 7 | 4.5 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1CCC(=O)N(C(Cc2ccccc2)C(N)=O)CC1 | 10.1021/jm00037a005 | ||
44329384 | 206590 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 556 | 7 | 3 | 4 | 5.6 | COc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL99289 | 206590 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 556 | 7 | 3 | 4 | 5.6 | COc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
89913304 | 140240 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 249 | 2 | 1 | 2 | 2.0 | O=C1C=C(Cl)C(O)(c2ccccc2)N1C1CC1 | 10.1039/C6MD00052E | ||
CHEMBL3818437 | 140240 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 249 | 2 | 1 | 2 | 2.0 | O=C1C=C(Cl)C(O)(c2ccccc2)N1C1CC1 | 10.1039/C6MD00052E | ||
5279123 | 202836 | 1 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00120a002 | ||
CHEMBL72841 | 202836 | 1 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00120a002 | ||
15614763 | 67424 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 401 | 3 | 3 | 2 | 5.1 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)N[C@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL1907932 | 67424 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 401 | 3 | 3 | 2 | 5.1 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)N[C@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
5279123 | 202836 | 1 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00047a021 | ||
CHEMBL72841 | 202836 | 1 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1Cl | 10.1021/jm00047a021 | ||
14991538 | 106343 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 921 | 24 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL3144566 | 106343 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 921 | 24 | 9 | 11 | 2.4 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
52949124 | 863 | 2 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | - | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10481933 | 13185 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 524 | 5 | 2 | 5 | 3.1 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL1191818 | 13185 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 524 | 5 | 2 | 5 | 3.1 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL542967 | 13185 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 524 | 5 | 2 | 5 | 3.1 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1021/jm00078a018 | ||
44279808 | 98684 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 712 | 13 | 6 | 9 | 2.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL281082 | 98684 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 712 | 13 | 6 | 9 | 2.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCC(=O)NCCSCc3csc(N=C(N)N)n3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
10369804 | 16581 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1cccc2c1N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
CHEMBL124340 | 16581 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 532 | 5 | 3 | 3 | 5.6 | Cc1cccc2c1N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(Cl)c1)C[C@@H]2c1ccccc1 | 10.1021/jm00048a015 | ||
9984452 | 164751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL423329 | 164751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
44283055 | 116112 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.4 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80156-0 | ||
CHEMBL336769 | 116112 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.4 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1)OC1C2CC3CC(C2)CC1C3 | 10.1016/S0960-894X(00)80156-0 | ||
14208282 | 67344 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.4 | CC(C)CCC(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00120a002 | ||
CHEMBL1907663 | 67344 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.4 | CC(C)CCC(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O | 10.1021/jm00120a002 | ||
9984452 | 164751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL423329 | 164751 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00105a062 | ||
15177358 52940604 | 16353 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 667 | 9 | 4 | 4 | 7.1 | ClC(Cl)(Cl)Cl.O=C(NC(Cc1c[nH]c2ccccc12)NC(=O)C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL1237153 | 16353 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 667 | 9 | 4 | 4 | 7.1 | ClC(Cl)(Cl)Cl.O=C(NC(Cc1c[nH]c2ccccc12)NC(=O)C(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
44368624 | 120620 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 9 | 4 | 3 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL357564 | 120620 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 9 | 4 | 3 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
9984452 | 29501 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm970065l | ||
CHEMBL138657 | 29501 | 0 | None | - | 1 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 529 | 9 | 4 | 4 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm970065l | ||
44368329 | 120490 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL356446 | 120490 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3)C(=O)NCCc1ccccc1 | 10.1021/jm00057a005 | ||
10483574 | 6129 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 591 | 8 | 2 | 5 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm950626d | ||
CHEMBL108130 | 6129 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 591 | 8 | 2 | 5 | 5.3 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm950626d | ||
73351320 | 105666 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 681 | 12 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNC(=O)C(F)(F)F)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL313559 | 105666 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 681 | 12 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCNC(=O)C(F)(F)F)c1ccccc1 | 10.1021/jm00092a007 | ||
6439414 | 2976 | 11 | None | -2454 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 10.1021/jm00105a062 | ||
867 | 2976 | 11 | None | -2454 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 10.1021/jm00105a062 | ||
CHEMBL3351022 | 2976 | 11 | None | -2454 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 10.1021/jm00105a062 | ||
CHEMBL341460 | 2976 | 11 | None | -2454 | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 10.1021/jm00105a062 | ||
44368728 | 119001 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 596 | 11 | 5 | 4 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL345512 | 119001 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 596 | 11 | 5 | 4 | 4.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1021/jm00057a005 | ||
14208306 | 202486 | 1 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL70791 | 202486 | 1 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)C(NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00047a021 | ||
44451577 | 95341 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 546 | 6 | 2 | 5 | 2.1 | Cc1cccc(NC(=O)NC2C(=O)N(CC(=O)N3CCCC3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL258630 | 95341 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 546 | 6 | 2 | 5 | 2.1 | Cc1cccc(NC(=O)NC2C(=O)N(CC(=O)N3CCCC3)c3ccccc3N(CC(=O)N3CCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
15689723 | 106113 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C(F)(F)F)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142693 | 106113 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccccc1C(F)(F)F)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
89913313 | 140259 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 299 | 3 | 1 | 2 | 3.1 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
CHEMBL3818718 | 140259 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 299 | 3 | 1 | 2 | 3.1 | CC(C)CN1C(=O)C=C(Cl)C1(O)c1ccc(Cl)cc1 | 10.1039/C6MD00052E | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00163a069 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00163a069 | ||
44578305 | 180588 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 520 | 5 | 0 | 5 | 6.1 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL476095 | 180588 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 520 | 5 | 0 | 5 | 6.1 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
14991571 | 201247 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 905 | 21 | 8 | 10 | 3.9 | CC(=O)Oc1ccc2cc(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(N)=O)ccc2c1 | 10.1021/jm00089a010 | ||
CHEMBL62887 | 201247 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 905 | 21 | 8 | 10 | 3.9 | CC(=O)Oc1ccc2cc(C(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc3ccccc3)C(N)=O)ccc2c1 | 10.1021/jm00089a010 | ||
104929 | 2189 | 8 | None | - | 3 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00121a004 | ||
3477 | 2189 | 8 | None | - | 3 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00121a004 | ||
879 | 2189 | 8 | None | - | 3 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00121a004 | ||
CHEMBL289498 | 2189 | 8 | None | - | 3 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm00121a004 | ||
10009894 | 25424 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 694 | 13 | 6 | 6 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1016/s0960-894x(01)00630-8 | ||
CHEMBL13517 | 25424 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 694 | 13 | 6 | 6 | 4.9 | Cc1ccccc1NC(=O)NCCCC[C@@H](CC(=O)O)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1016/s0960-894x(01)00630-8 | ||
10070679 | 27560 | 11 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2cccc(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL137066 | 27560 | 11 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 418 | 3 | 2 | 3 | 4.3 | CN1C(=O)C(NC(=O)Nc2cccc(Cl)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL407530 | 210920 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00100a033 | ||||
14208194 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000937a | ||
CHEMBL419764 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm000937a | ||
14208243 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL72073 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
14208194 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL419764 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
10452597 | 26720 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 384 | 3 | 2 | 3 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136408 | 26720 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 384 | 3 | 2 | 3 | 3.6 | CN1C(=O)C(NC(=O)Nc2ccccc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
14208243 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL72073 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
14208194 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL419764 | 162884 | 2 | None | 1122 | 2 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80684-8 | ||
14208243 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
CHEMBL72073 | 202712 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 403 | 3 | 1 | 3 | 3.9 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00047a021 | ||
10817395 | 106658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 600 | 8 | 1 | 4 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
CHEMBL316164 | 106658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 600 | 8 | 1 | 4 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm960249k | ||
10817395 | 106658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 600 | 8 | 1 | 4 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL316164 | 106658 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 600 | 8 | 1 | 4 | 6.9 | COc1ccc(N(C(=O)CN2C(=O)C(C)(Cc3c[nH]c4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
15689727 | 106111 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(Cl)cc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
CHEMBL3142690 | 106111 | 0 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 880 | 20 | 9 | 8 | 4.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(Cl)cc1Cl)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||
44578455 | 181873 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
CHEMBL478630 | 181873 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 503 | 5 | 0 | 6 | 5.4 | COc1cccc(-n2cc(C(=O)N3CCN(c4ccc5ncccc5c4)CC3)nc2-c2ccc(C)cc2)c1 | 10.1016/j.bmcl.2008.06.057 | ||
10480792 | 45543 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL153095 | 45543 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL3350686 | 45543 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 491 | 9 | 4 | 4 | 4.5 | CC1CCCCC1OC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H](CO)Cc1ccccc1 | 10.1021/jm00057a005 | ||
14208210 | 202502 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 413 | 3 | 2 | 4 | 4.1 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2o1 | 10.1021/jm00047a021 | ||
CHEMBL70856 | 202502 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 413 | 3 | 2 | 4 | 4.1 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2o1 | 10.1021/jm00047a021 | ||
21842365 | 119249 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 6 | 2 | 5 | 4.5 | Cc1cccc(NC(=O)NC2N=C(c3cccnc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL347843 | 119249 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 495 | 6 | 2 | 5 | 4.5 | Cc1cccc(NC(=O)NC2N=C(c3cccnc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
11765257 | 108345 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
CHEMBL320980 | 108345 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 695 | 10 | 2 | 6 | 6.6 | COc1ccc(N(C(=O)CN2C(=O)C(NC(=O)Nc3cccc(C(=O)c4ccccc4)c3)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1016/s0960-894x(98)00548-4 | ||
46234820 | 73292 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 572 | 6 | 1 | 5 | 6.1 | CC(C)C1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017826 | 73292 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 572 | 6 | 1 | 5 | 6.1 | CC(C)C1CCCCN1C(=O)CN1C(=O)C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL328422 | 209550 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | Cc1cccc(C)c1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
89913684 | 140238 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 299 | 3 | 1 | 2 | 3.0 | O=C1C=C(Cl)C(O)(c2ccccc2)N1Cc1ccccc1 | 10.1039/C6MD00052E | ||
CHEMBL3818410 | 140238 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 299 | 3 | 1 | 2 | 3.0 | O=C1C=C(Cl)C(O)(c2ccccc2)N1Cc1ccccc1 | 10.1039/C6MD00052E | ||
14208307 | 77471 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092867 | 77471 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 3 | 1 | 3 | 4.0 | CN1C(=O)[C@@H](NC(=O)c2ccccc2I)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
14208283 | 67343 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 375 | 3 | 1 | 3 | 3.5 | CN1C(=O)[C@@H](NC(=O)C2CCCCC2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL1907662 | 67343 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 375 | 3 | 1 | 3 | 3.5 | CN1C(=O)[C@@H](NC(=O)C2CCCCC2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
20190197 | 31304 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 421 | 4 | 1 | 3 | 4.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1ccc(Cl)cc1 | 10.1021/jm00163a069 | ||
CHEMBL140365 | 31304 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 421 | 4 | 1 | 3 | 4.6 | CN1c2ccccc2C(c2ccccc2F)=NCC1CNC(=O)c1ccc(Cl)cc1 | 10.1021/jm00163a069 | ||
10075052 | 189082 | 0 | None | - | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL515268 | 189082 | 0 | None | - | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL515288 | 189082 | 0 | None | - | 2 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
44334320 | 4954 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 531 | 9 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](C[S+]([O-])Cc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL105132 | 4954 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 531 | 9 | 2 | 4 | 4.6 | Cc1cccc(NC(=O)N[C@H](C[S+]([O-])Cc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
15673150 | 85567 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 681 | 12 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCNC(=O)C(F)(F)F)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
CHEMBL2304154 | 85567 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 681 | 12 | 5 | 5 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@H](NC(=O)CCNC(=O)C(F)(F)F)c1ccccc1 | 10.1016/S0960-894X(00)80652-6 | ||
44349413 | 112608 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 410 | 12 | 3 | 3 | 4.0 | CCC(CC)(CC)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL331413 | 112608 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 410 | 12 | 3 | 3 | 4.0 | CCC(CC)(CC)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
44360216 | 32016 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 403 | 5 | 3 | 4 | 3.3 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)C(O)c1ccccc1 | 10.1021/jm00163a069 | ||
CHEMBL140974 | 32016 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 403 | 5 | 3 | 4 | 3.3 | O=C(NCC1CNc2ccccc2C(c2ccccc2F)=N1)C(O)c1ccccc1 | 10.1021/jm00163a069 | ||
44349240 | 117614 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 368 | 11 | 3 | 3 | 3.0 | CCCCCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL340755 | 117614 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 368 | 11 | 3 | 3 | 3.0 | CCCCCCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
9800177 | 67367 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 383 | 3 | 2 | 2 | 4.7 | O=C1Nc2ccccc2C(c2ccccc2F)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
CHEMBL1907714 | 67367 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 383 | 3 | 2 | 2 | 4.7 | O=C1Nc2ccccc2C(c2ccccc2F)=N[C@@H]1Cc1c[nH]c2ccccc12 | 10.1021/jm00390a019 | ||
15614841 | 67379 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 390 | 5 | 1 | 3 | 4.7 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1COCc1ccccc1 | 10.1021/jm00390a019 | ||
CHEMBL1907734 | 67379 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 390 | 5 | 1 | 3 | 4.7 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=N[C@@H]1COCc1ccccc1 | 10.1021/jm00390a019 | ||
CHEMBL286843 | 99560 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 541 | 8 | 3 | 4 | 7.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C1NC=C(CCc2ccccc2)S1 | 10.1021/jm00086a017 | ||
10480605 | 77957 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 487 | 5 | 4 | 7 | 3.7 | Cc1ccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)cc1Nc1nn[nH]n1 | 10.1021/jm9506736 | ||
CHEMBL2110201 | 77957 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 487 | 5 | 4 | 7 | 3.7 | Cc1ccc(NC(=O)N[C@@H]2N=C(C3CCCCC3)c3ccccc3N(C)C2=O)cc1Nc1nn[nH]n1 | 10.1021/jm9506736 | ||
44349411 | 16664 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 380 | 7 | 3 | 3 | 3.1 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCC1 | 10.1021/jm00079a003 | ||
CHEMBL124802 | 16664 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 380 | 7 | 3 | 3 | 3.1 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)NC1CCCCCC1 | 10.1021/jm00079a003 | ||
44283159 | 99672 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 8 | 3 | 3 | 6.6 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)/C(S)=N/CCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL287682 | 99672 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 8 | 3 | 3 | 6.6 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)/C(S)=N/CCc1ccccc1 | 10.1021/jm00086a017 | ||
44331065 | 106742 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 974 | 25 | 8 | 11 | 1.3 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL316709 | 106742 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 974 | 25 | 8 | 11 | 1.3 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
15667015 | 161305 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 990 | 29 | 10 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL414793 | 161305 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 990 | 29 | 10 | 11 | 2.0 | CCCC[C@H](NC(=O)CCc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
14208253 | 203003 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(Cl)c1 | 10.1021/jm00120a002 | ||
CHEMBL74125 | 203003 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(Cl)c1 | 10.1021/jm00120a002 | ||
14208253 | 203003 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(Cl)c1 | 10.1021/jm00047a021 | ||
CHEMBL74125 | 203003 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 3 | 2 | 3 | 3.9 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc(Cl)c1 | 10.1021/jm00047a021 | ||
14802508 | 78381 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 615 | 12 | 4 | 6 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC(OC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2112695 | 78381 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 615 | 12 | 4 | 6 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCC(OC(=O)CCC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
15104629 | 109630 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 7 | 3 | 3 | 4.9 | C[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
CHEMBL323627 | 109630 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 7 | 3 | 3 | 4.9 | C[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc2ccccc2c1)c1ccccc1 | 10.1021/jm00116a002 | ||
14720386 | 48060 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 463 | 12 | 2 | 4 | 4.4 | CCCN(CCC)C(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL155406 | 48060 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 463 | 12 | 2 | 4 | 4.4 | CCCN(CCC)C(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
44329055 | 206225 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 554 | 7 | 3 | 3 | 6.1 | CCc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL97133 | 206225 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 554 | 7 | 3 | 3 | 6.1 | CCc1ccccc1[C@H]1C[C@@H](NC(=O)Nc2cccc(C)c2)C(=O)N(CC(=O)NC(C)(C)C)[C@@H](c2ccccc2)C1 | 10.1016/S0960-894X(01)80832-5 | ||
44382706 | 58711 | 1 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](c2ccccc2)[C@@H]1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
CHEMBL169274 | 58711 | 1 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 475 | 3 | 2 | 2 | 5.9 | O=C1NN(C(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](c2ccccc2)[C@@H]1c1ccccc1 | 10.1016/S0960-894X(00)80684-8 | ||
11667741 | 194907 | 0 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 366 | 4 | 1 | 5 | 2.5 | Cc1c(CC(=O)O)c2cccnc2n1S(=O)(=O)c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.042 | ||
CHEMBL563949 | 194907 | 0 | None | - | 2 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 366 | 4 | 1 | 5 | 2.5 | Cc1c(CC(=O)O)c2cccnc2n1S(=O)(=O)c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.042 | ||
10528465 | 96603 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 473 | 7 | 4 | 7 | 4.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(=O)O)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL267023 | 96603 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 473 | 7 | 4 | 7 | 4.0 | CC(C)Oc1cccc(-n2c(NNC(=O)Nc3cccc(C(=O)O)c3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL2369769 | 207940 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | C/C=C/CC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/0960-894X(94)85022-4 | ||||
11700447 | 72678 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
CHEMBL200953 | 72678 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 717 | 10 | 6 | 6 | 3.7 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)N[C@@H](Cc3ccccc3)C(N)=O)N2C1=O | 10.1021/jm050689o | ||
13953716 | 101126 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 442 | 3 | 2 | 5 | 4.9 | Cc1nnc2n1-c1ccccc1C(c1ccccc1)=NC2NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00396a028 | ||
CHEMBL298705 | 101126 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 442 | 3 | 2 | 5 | 4.9 | Cc1nnc2n1-c1ccccc1C(c1ccccc1)=NC2NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00396a028 | ||
44281292 | 114296 | 0 | None | - | 1 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 816 | 17 | 5 | 9 | 5.0 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCNC(=O)CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
CHEMBL33398 | 114296 | 0 | None | - | 1 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 816 | 17 | 5 | 9 | 5.0 | CN1C(=O)[C@H](NC(=O)Nc2cccc(COC(=O)NCCNC(=O)CC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00249-1 | ||
44329456 | 110957 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 526 | 6 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL327526 | 110957 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 526 | 6 | 3 | 3 | 5.5 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
10995425 | 114958 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=S)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010898i | ||
CHEMBL3350859 | 114958 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 575 | 7 | 3 | 5 | 4.3 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=S)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm010898i | ||
44592486 | 187244 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL496067 | 187244 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 7 | 4 | 3 | 3.6 | CC(C)CC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
155557285 | 173946 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1779 | 74 | 19 | 22 | 1.6 | CCCC[C@H](NC(=O)[C@H](CNC(=O)CCCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4555341 | 173946 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1779 | 74 | 19 | 22 | 1.6 | CCCC[C@H](NC(=O)[C@H](CNC(=O)CCCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44373702 | 119421 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 555 | 8 | 4 | 4 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@]1(C(=O)O)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
CHEMBL349473 | 119421 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 555 | 8 | 4 | 4 | 5.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@]1(C(=O)O)C[C@H]1c1ccccc1 | 10.1016/S0960-894X(01)81250-6 | ||
44286696 | 167422 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 796 | 18 | 6 | 7 | 4.4 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL431912 | 167422 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 796 | 18 | 6 | 7 | 4.4 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CC(=O)N(C)C(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL170026 | 207097 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@H](Cc2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
10004579 | 78107 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Br)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL2111923 | 78107 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 462 | 3 | 2 | 3 | 4.4 | CN1C(=O)[C@H](NC(=O)Nc2cccc(Br)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
15281997 | 48238 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3nccn3C)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL155627 | 48238 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 486 | 5 | 2 | 6 | 3.7 | Cc1cccc(NC(=O)NC2N=C(c3nccn3C)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL2369762 | 207935 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CCCCC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/0960-894X(94)85022-4 | ||||
44209152 | 58850 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 336 | 2 | 3 | 2 | 5.0 | O=C(Nc1ccc(Cl)cc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL169953 | 58850 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 336 | 2 | 3 | 2 | 5.0 | O=C(Nc1ccc(Cl)cc1)Nc1cc2c3ccccc3nc-2c[nH]1 | 10.1016/S0960-894X(00)80682-4 | ||
73349792 | 156872 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 669 | 13 | 5 | 7 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCSc1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL407857 | 156872 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 669 | 13 | 5 | 7 | 5.3 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCSc1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
44354100 | 116269 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL337661 | 116269 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
44354100 | 120298 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL355656 | 120298 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
101823779 | 1369 | 29 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
16162108 | 1369 | 29 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
8408 | 1369 | 29 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
CHEMBL4451154 | 1369 | 29 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b01558 | ||||
44408632 | 157692 | 0 | None | -3630 | 4 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL408832 | 157692 | 0 | None | -3630 | 4 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
44283055 | 99295 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.4 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL285049 | 99295 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 9 | 4 | 4 | 4.4 | O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NC(CO)Cc1ccccc1)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
44591979 | 178482 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 426 | 7 | 4 | 3 | 3.2 | NC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL471465 | 178482 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 426 | 7 | 4 | 3 | 3.2 | NC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1cc2ccccc2[nH]1 | 10.1016/j.bmc.2009.02.012 | ||
54587151 | 61537 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 545 | 6 | 0 | 7 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1OC | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1773889 | 61537 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 545 | 6 | 0 | 7 | 5.6 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cnc5ccccc5c4)CC3)nc2-c2ccc(C)cc2)cc1OC | 10.1016/j.bmcl.2011.03.069 | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/0960-894X(95)00327-P | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00048a015 | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00048a015 | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL2111881 | 207476 | 0 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)[C@H](C)c1c[nH]c2ccccc12 | 10.1021/jm960078j | ||||
CHEMBL2111882 | 207477 | 0 | None | - | 0 | Guinea pig | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)c1c[nH]c2ccccc12 | 10.1021/jm960078j | ||||
44349278 | 16429 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 388 | 10 | 3 | 3 | 3.3 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL124090 | 16429 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 388 | 10 | 3 | 3 | 3.3 | CCCCCNC(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00079a003 | ||
44283177 | 99840 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 655 | 16 | 2 | 5 | 7.6 | CCOC(=O)CCCCCC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL289239 | 99840 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 655 | 16 | 2 | 5 | 7.6 | CCOC(=O)CCCCCC(=O)N(CCc1ccccc1)CC(C)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
44283085 | 99444 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 484 | 9 | 2 | 2 | 7.4 | CC(CCCCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
CHEMBL286093 | 99444 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 484 | 9 | 2 | 2 | 7.4 | CC(CCCCc1ccccc1)(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00086a017 | ||
14208239 | 202793 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 4 | 3 | 3 | 4.2 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1NCc1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
CHEMBL72550 | 202793 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 4 | 3 | 3 | 4.2 | O=C1Nc2ccccc2C(c2ccccc2F)=NC1NCc1cc2ccccc2[nH]1 | 10.1021/jm00120a002 | ||
10698051 | 204805 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 5.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
CHEMBL88545 | 204805 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 5.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm960249k | ||
10698051 | 204805 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 5.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm970265x | ||
CHEMBL88545 | 204805 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 557 | 7 | 1 | 4 | 5.9 | CC(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm970265x | ||
70683305 | 73300 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 635 | 7 | 1 | 6 | 6.4 | Cc1cccc(CC2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017834 | 73300 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 635 | 7 | 1 | 6 | 6.4 | Cc1cccc(CC2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1016/j.bmcl.2012.02.049 | ||
14802543 | 169911 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 600 | 11 | 5 | 5 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL2112693 | 169911 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 600 | 11 | 5 | 5 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL444902 | 169911 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 600 | 11 | 5 | 5 | 4.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NC[C@H](NC(=O)CC(=O)O)c1ccccc1 | 10.1021/jm00105a062 | ||
44336539 | 5075 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
CHEMBL105775 | 5075 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 563 | 7 | 2 | 5 | 4.6 | COc1ccc(N(C)C(=O)CN2C(=O)C(NC(=O)Nc3ccccc3)C(=O)N(c3ccccc3)c3ccccc32)cc1 | 10.1016/j.bmcl.2015.03.051 | ||
44349044 | 112808 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
CHEMBL331532 | 112808 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1021/jm000959x | ||
44349044 | 112808 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
CHEMBL331532 | 112808 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NC(=O)OCc3ccccc3)C(=O)N12 | 10.1016/s0960-894x(98)00677-5 | ||
15104617 | 9908 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2cn1 | 10.1021/jm00116a002 | ||
CHEMBL114916 | 9908 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 498 | 13 | 2 | 3 | 6.3 | CCCCCN(CCCCC)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2ccccc2cn1 | 10.1021/jm00116a002 | ||
14720390 | 49125 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
CHEMBL156415 | 49125 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 373 | 10 | 3 | 3 | 2.8 | CCCN(CCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1cc2ccccc2[nH]1 | 10.1021/jm00164a020 | ||
44349429 | 16658 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 406 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)C1CC2CCCCC2CN1 | 10.1021/jm00079a003 | ||
CHEMBL124780 | 16658 | 0 | None | - | 0 | Rat | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 406 | 7 | 3 | 4 | 3.0 | O=C(O)CCC(NC(=O)c1cccc(Cl)c1)C(=O)C1CC2CCCCC2CN1 | 10.1021/jm00079a003 | ||
23928173 | 113649 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 511 | 6 | 2 | 5 | 4.7 | CN(C)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
CHEMBL332931 | 113649 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 511 | 6 | 2 | 5 | 4.7 | CN(C)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm960669+ | ||
44381949 | 120212 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 3 | 3 | 4 | 4.6 | CN1C(=O)[C@H](NC(=O)Nc2cc3c4ccccc4nc-3c[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
CHEMBL354802 | 120212 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 474 | 3 | 3 | 4 | 4.6 | CN1C(=O)[C@H](NC(=O)Nc2cc3c4ccccc4nc-3c[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/S0960-894X(00)80682-4 | ||
14208209 | 163353 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 402 | 5 | 3 | 4 | 3.2 | O=C(CNc1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
CHEMBL420722 | 163353 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 402 | 5 | 3 | 4 | 3.2 | O=C(CNc1ccccc1)NC1N=C(c2ccccc2F)c2ccccc2NC1=O | 10.1021/jm00047a021 | ||
10841112 | 205367 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 588 | 8 | 0 | 6 | 6.1 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3noc4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
CHEMBL91986 | 205367 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 588 | 8 | 0 | 6 | 6.1 | COc1ccc(N(C(=O)CN2C(=O)C(Cc3noc4ccccc34)C(=O)N(c3ccccc3)c3ccccc32)C(C)C)cc1 | 10.1021/jm970265x | ||
10048206 | 196978 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 428 | 7 | 3 | 4 | 4.1 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2o1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL579245 | 196978 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 428 | 7 | 3 | 4 | 4.1 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2o1 | 10.1016/j.bmc.2009.05.067 | ||
10674604 | 167365 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 571 | 6 | 1 | 4 | 6.3 | CC(C)(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm970265x | ||
CHEMBL431451 | 167365 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 571 | 6 | 1 | 4 | 6.3 | CC(C)(C)N(C(=O)CN1C(=O)C(Cc2n[nH]c3ccccc23)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1021/jm970265x | ||
16100408 | 141259 | 0 | None | -1202 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL386186 | 141259 | 0 | None | -1202 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
14208210 | 202502 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 413 | 3 | 2 | 4 | 4.1 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2o1 | 10.1021/jm00120a002 | ||
CHEMBL70856 | 202502 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 413 | 3 | 2 | 4 | 4.1 | O=C(NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1cc2ccccc2o1 | 10.1021/jm00120a002 | ||
14208268 | 202779 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 418 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL72428 | 202779 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 418 | 3 | 2 | 4 | 3.5 | CN1C(=O)C(NC(=O)c2ccc(Cl)cc2N)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00120a002 | ||
10073533 | 22354 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 472 | 7 | 3 | 5 | 3.5 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
CHEMBL132603 | 22354 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 472 | 7 | 3 | 5 | 3.5 | COc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CCC(=O)O)C2=O)c1 | 10.1021/jm00078a018 | ||
155543846 | 172641 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1838 | 72 | 19 | 24 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4522865 | 172641 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 1838 | 72 | 19 | 24 | 2.4 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
10484212 | 99417 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL285921 | 99417 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 635 | 6 | 3 | 7 | 4.3 | Cc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)C(NC(=O)Nc1cccc(-c3nn[nH]n3)c1)N=C2c1ccccc1F | 10.1016/S0960-894X(96)00609-9 | ||
CHEMBL3142923 | 209391 | 0 | None | - | 0 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | COc1cccc(NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c1 | 10.1021/jm960509y | ||||
53465844 | 69068 | 0 | None | - | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | - | 2 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL208479 | 207455 | 0 | None | -3 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
46235272 | 73298 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 8 | 1 | 7 | 4.9 | COCCC1CCCCN1C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017832 | 73298 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 589 | 8 | 1 | 7 | 4.9 | COCCC1CCCCN1C(=O)CN1C(=O)[C@@H](Cc2n[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc21 | 10.1016/j.bmcl.2012.02.049 | ||
54586175 | 61589 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 504 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccoc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774037 | 61589 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 504 | 5 | 0 | 6 | 5.8 | COc1ccc(-c2cnc(C(=O)N3CCN(c4ccc5ccoc5c4)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
15667018 | 157240 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 998 | 27 | 10 | 11 | 2.5 | CCCC[C@H](NC(=O)c1ccc2cc(OS(=O)(=O)O)ccc2c1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
CHEMBL408286 | 157240 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 998 | 27 | 10 | 11 | 2.5 | CCCC[C@H](NC(=O)c1ccc2cc(OS(=O)(=O)O)ccc2c1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00094a001 | ||
14208212 | 102478 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 396 | 3 | 3 | 4 | 3.0 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)C1Cc2ccccc2N1 | 10.1021/jm00120a002 | ||
CHEMBL306369 | 102478 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 396 | 3 | 3 | 4 | 3.0 | O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)C1Cc2ccccc2N1 | 10.1021/jm00120a002 | ||
44311593 | 102546 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00120a002 | ||
CHEMBL306958 | 102546 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 402 | 3 | 2 | 3 | 3.8 | CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1 | 10.1021/jm00120a002 | ||
11114607 | 114953 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 591 | 7 | 3 | 5 | 5.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=S)N(Cc3ccccc3)C(=S)C[C@H]12 | 10.1021/jm010898i | ||
CHEMBL3350852 | 114953 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 591 | 7 | 3 | 5 | 5.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=S)N(Cc3ccccc3)C(=S)C[C@H]12 | 10.1021/jm010898i | ||
19018662 | 26307 | 11 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 424 | 3 | 2 | 3 | 4.1 | CN1C(=O)C(NC(=O)Nc2ccc3c(c2)CCC3)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
CHEMBL136038 | 26307 | 11 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 424 | 3 | 2 | 3 | 4.1 | CN1C(=O)C(NC(=O)Nc2ccc3c(c2)CCC3)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00078a018 | ||
10436569 | 77492 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)N[C@@H]1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
CHEMBL2092976 | 77492 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 515 | 5 | 2 | 4 | 4.3 | O=C(Nc1ccc(Cl)cc1)N[C@@H]1N=C(c2ccccc2)c2ccccc2N(CC(=O)N2CCCC2)C1=O | 10.1021/jm00078a018 | ||
44280224 | 104305 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 757 | 16 | 4 | 7 | 5.8 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL31090 | 104305 | 0 | None | - | 1 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 757 | 16 | 4 | 7 | 5.8 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44334337 | 4607 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 541 | 10 | 2 | 5 | 5.1 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL103276 | 4607 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 541 | 10 | 2 | 5 | 5.1 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL34853 | 209968 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | None | None | None | CCS[C@H]1CCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00001a019 | ||||
14208300 | 77470 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@H](NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
CHEMBL2092866 | 77470 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 465 | 3 | 1 | 3 | 4.2 | CN1C(=O)[C@H](NC(=O)c2ccccc2Br)N=C(c2ccccc2F)c2ccccc21 | 10.1021/jm00120a002 | ||
10474221 | 16670 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 368 | 8 | 3 | 3 | 2.9 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
CHEMBL124822 | 16670 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 368 | 8 | 3 | 3 | 2.9 | CC(C)(C)CCNC(=O)C(CCC(=O)O)NC(=O)c1cccc(Cl)c1 | 10.1021/jm00079a003 | ||
14991565 | 198658 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 839 | 23 | 8 | 8 | 3.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL59759 | 198658 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 839 | 23 | 8 | 8 | 3.6 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)CCCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00089a010 | ||
CHEMBL408083 | 210951 | 0 | None | -2 | 4 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
11812882 | 78184 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 483 | 5 | 3 | 5 | 2.5 | CN1C(=O)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
CHEMBL2112236 | 78184 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 483 | 5 | 3 | 5 | 2.5 | CN1C(=O)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm010813d | ||
44591826 | 191934 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 425 | 8 | 3 | 5 | 3.4 | CSCCC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2n1C)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
CHEMBL520997 | 191934 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 425 | 8 | 3 | 5 | 3.4 | CSCCC(NC(=O)c1ccccc1NC(=O)c1cc2ccccc2n1C)C(=O)O | 10.1016/j.bmc.2009.02.012 | ||
44279862 | 98673 | 0 | None | - | 1 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 702 | 13 | 3 | 7 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL281017 | 98673 | 0 | None | - | 1 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 702 | 13 | 3 | 7 | 5.9 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
44286976 | 141413 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 768 | 18 | 8 | 7 | 3.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
CHEMBL38716 | 141413 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 768 | 18 | 8 | 7 | 3.7 | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)NCC(=O)NC(Cc1ccccc1)C(N)=O | 10.1021/jm00037a005 | ||
15670985 | 205362 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 490 | 9 | 3 | 5 | 3.2 | COc1cccc(N(CC(=O)N(C)c2ccccc2)C(=O)CNC(=O)Nc2cccc(C(=O)O)c2)c1 | 10.1021/jm970373j | ||
CHEMBL9195 | 205362 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 490 | 9 | 3 | 5 | 3.2 | COc1cccc(N(CC(=O)N(C)c2ccccc2)C(=O)CNC(=O)Nc2cccc(C(=O)O)c2)c1 | 10.1021/jm970373j | ||
CHEMBL3142681 | 209380 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00113a023 | ||||
70681224 | 73295 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
CHEMBL2017829 | 73295 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 621 | 7 | 1 | 6 | 6.1 | O=C1C(Cc2c[nH]c3ccccc23)c2nnc(-c3ccccc3)n2-c2ccccc2N1CC(=O)N1CCCCC1Cc1ccccn1 | 10.1016/j.bmcl.2012.02.049 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL328422 | 209550 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | None | None | None | Cc1cccc(C)c1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00173a006 | ||||
44381829 | 167963 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@H](CNN[C@@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)Cc1c[nH]c2ccccc12 | 10.1016/S0960-894X(00)80680-0 | ||
CHEMBL435465 | 167963 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 840 | 23 | 10 | 10 | 2.9 | CC(C)(C)OC(=O)N[C@H](CNN[C@@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)Cc1c[nH]c2ccccc12 | 10.1016/S0960-894X(00)80680-0 | ||
10392523 | 206206 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL96970 | 206206 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1cccc(NC(=O)N[C@@H]2C[C@H](c3ccccc3C)C[C@H](c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1 | 10.1016/S0960-894X(01)80832-5 | ||
44370406 | 49617 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 529 | 16 | 2 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCc1ccccc1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
CHEMBL156814 | 49617 | 0 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 529 | 16 | 2 | 4 | 6.6 | CCCCCN(CCCCC)C(=O)C(CCC(=O)OCc1ccccc1)NC(=O)Nc1ccc(Cl)cc1 | 10.1021/jm00164a020 | ||
70684970 | 77495 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 395 | 3 | 0 | 3 | 4.5 | CN1C[C@@H](CC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
CHEMBL2092990 | 77495 | 0 | None | - | 0 | Guinea pig | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 395 | 3 | 0 | 3 | 4.5 | CN1C[C@@H](CC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c2ccccc21 | 10.1021/jm00390a019 | ||
44283515 | 99712 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 516 | 8 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)SCCc1ccccc1 | 10.1021/jm00086a017 | ||
CHEMBL288038 | 99712 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 516 | 8 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)SCCc1ccccc1 | 10.1021/jm00086a017 | ||
155540415 | 172370 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 1862 | 71 | 17 | 23 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
CHEMBL4516868 | 172370 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 1862 | 71 | 17 | 23 | 3.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.8b01558 | ||
44349348 | 16754 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 412 | 7 | 3 | 5 | 2.2 | N#Cc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
CHEMBL125316 | 16754 | 0 | None | - | 0 | Rat | 4.0 | pIC50 | = | 4.0 | Binding | ChEMBL | 412 | 7 | 3 | 5 | 2.2 | N#Cc1cccc(C(=O)NC(CCC(=O)O)C(=O)NN2CCC3(CCCC3)CC2)c1 | 10.1021/jm00079a003 | ||
45482490 | 196463 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2c(F)cccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
CHEMBL574715 | 196463 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 445 | 7 | 4 | 3 | 4.0 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2c(F)cccc2[nH]1 | 10.1016/j.bmc.2009.05.067 | ||
19766168 | 59245 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 367 | 4 | 3 | 3 | 2.5 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)O)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL171722 | 59245 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 367 | 4 | 3 | 3 | 2.5 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)O)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
71452691 | 78219 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 671 | 12 | 5 | 7 | 3.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)C[S+]([O-])c1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL2112336 | 78219 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 671 | 12 | 5 | 7 | 3.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)C[S+]([O-])c1nc[nH]n1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL172635 | 207111 | 0 | None | - | 0 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N1C[C@H](c2ccccc2)NC(=O)[C@@H]1CC(=O)O | 10.1016/S0960-894X(01)80253-5 | ||||
44280372 | 98928 | 0 | None | - | 1 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 5.8 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
CHEMBL282645 | 98928 | 0 | None | - | 1 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 787 | 17 | 4 | 8 | 5.8 | Cc1cccc(NC(=O)NC2N=C(c3cccc(OCC(=O)NCCCC(=O)NCCCOc4cccc(CN5CCCCC5)c4)c3)c3ccccc3N(C)C2=O)c1 | 10.1016/S0960-894X(96)00248-X | ||
136060577 | 87248 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 4 | 1 | 5 | 6.3 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccccc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
CHEMBL233647 | 87248 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 495 | 4 | 1 | 5 | 6.3 | O=C1c2ccccc2C(=O)N1Cc1c(O)ccc2c(/C=C/c3ccccc3)cc3nc4ccccc4n3c12 | 10.1016/j.bmcl.2007.02.071 | ||
22883501 | 10322 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 552 | 6 | 2 | 6 | 5.0 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCCC3)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL116300 | 10322 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 552 | 6 | 2 | 6 | 5.0 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N3CCCCC3)c2)N=C(c2ccccn2)c2ccccc21 | 10.1021/jm960669+ | ||
54583297 | 61592 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
CHEMBL1774040 | 61592 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 558 | 6 | 1 | 6 | 5.9 | COc1ccc(-c2cnc(C(=O)N3CCN(c4cc5ccccc5cc4C(=O)O)CC3)nc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2011.03.069 | ||
14208254 | 202801 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 403 | 4 | 2 | 4 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
CHEMBL72599 | 202801 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 403 | 4 | 2 | 4 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00047a021 | ||
14802520 | 115793 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
CHEMBL335914 | 115793 | 1 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00105a062 | ||
14802520 | 119854 | 1 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
CHEMBL353157 | 119854 | 1 | None | - | 1 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 628 | 13 | 5 | 5 | 4.7 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80685-X | ||
44368612 | 121482 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 13 | 5 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
CHEMBL359361 | 121482 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 13 | 5 | 4 | 4.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)C1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CNC(=O)CCC(=O)O)Cc1ccccc1 | 10.1021/jm00057a005 | ||
23815458 | 167232 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 483 | 5 | 3 | 5 | 4.2 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
CHEMBL430516 | 167232 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 483 | 5 | 3 | 5 | 4.2 | CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(N)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm960669+ | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
14208254 | 202801 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 403 | 4 | 2 | 4 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
CHEMBL72599 | 202801 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 403 | 4 | 2 | 4 | 3.4 | COc1ccc(C(=O)NC2N=C(c3ccccc3F)c3ccccc3NC2=O)cc1 | 10.1021/jm00120a002 | ||
44210427 | 120255 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 459 | 4 | 2 | 4 | 4.7 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL355319 | 120255 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 459 | 4 | 2 | 4 | 4.7 | CC(C)(C)OC(=O)CN1C(=O)C(NC(=O)Nc2cccc3ccccc23)CCc2ccccc21 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL382051 | 210546 | 0 | None | -489 | 4 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
10555245 | 96043 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1021/jm000959x | ||
CHEMBL262463 | 96043 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 580 | 9 | 4 | 5 | 3.9 | O=C(O)C[C@H](Cc1ccccc1)NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NC(=O)OCc3ccccc3)C(=O)N21 | 10.1021/jm000959x | ||
44210426 | 58806 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 449 | 4 | 2 | 4 | 2.2 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
CHEMBL169807 | 58806 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 449 | 4 | 2 | 4 | 2.2 | Cc1cccc(NC(=O)NC2CCc3ccccc3N(CC(=O)N3CCN(C)CC3)C2=O)c1 | 10.1016/S0960-894X(00)80683-6 | ||
44300863 | 196672 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 619 | 7 | 4 | 6 | 3.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(C)(=O)=O)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
CHEMBL57642 | 196672 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 619 | 7 | 4 | 6 | 3.7 | Cc1ccc2c(c1)N(CC(=O)NC(C)(C)C)C(=O)[C@H](NC(=O)Nc1cccc(C(=O)NS(C)(=O)=O)c1)C[C@@H]2c1ccccc1 | 10.1016/0960-894X(95)00327-P | ||
73349793 | 204730 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 12 | 5 | 7 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCc1nnn[nH]1)c1ccccc1 | 10.1021/jm00092a007 | ||
CHEMBL88090 | 204730 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 638 | 12 | 5 | 7 | 4.1 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NC[C@@H](NC(=O)CCc1nnn[nH]1)c1ccccc1 | 10.1021/jm00092a007 | ||
44329442 | 205938 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](c3ccccc3)C[C@@H](NC(=O)Nc3cccc(C)c3)C(=O)N2CC(=O)NC(C)(C)C)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
CHEMBL95369 | 205938 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 540 | 6 | 3 | 3 | 5.9 | Cc1ccc([C@H]2C[C@@H](c3ccccc3)C[C@@H](NC(=O)Nc3cccc(C)c3)C(=O)N2CC(=O)NC(C)(C)C)cc1 | 10.1016/S0960-894X(01)80832-5 | ||
44334237 | 107546 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 556 | 10 | 3 | 5 | 4.4 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(NC(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
CHEMBL319466 | 107546 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 556 | 10 | 3 | 5 | 4.4 | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N2CCC(NC(=O)c3ccccc3)CC2)c1 | 10.1016/0960-894X(95)00537-3 | ||
44370473 | 50589 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
CHEMBL157722 | 50589 | 0 | None | - | 0 | Guinea pig | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 435 | 15 | 3 | 4 | 4.3 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)Nc1cccc(OC)c1 | 10.1021/jm00164a020 | ||
10673193 | 97692 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 506 | 6 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
CHEMBL273693 | 97692 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 506 | 6 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1021/jm970373j | ||
10006792 | 44671 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 517 | 6 | 2 | 5 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
CHEMBL152306 | 44671 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 517 | 6 | 2 | 5 | 4.9 | Cc1cccc(NC(=O)NC2N=C(c3ccccn3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | 10.1016/0960-894X(95)00557-A | ||
44387108 | 167691 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 650 | 9 | 3 | 5 | 4.7 | COC(=O)[C@@]1(Cc2ccccc2)C[C@H]2[C@H](NC(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)C34CC5CC(CC(C5)C3)C4)CCCN2C1=O | 10.1016/0960-894X(96)00160-6 | ||
CHEMBL433770 | 167691 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 650 | 9 | 3 | 5 | 4.7 | COC(=O)[C@@]1(Cc2ccccc2)C[C@H]2[C@H](NC(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)C34CC5CC(CC(C5)C3)C4)CCCN2C1=O | 10.1016/0960-894X(96)00160-6 | ||
136055865 | 119691 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 4 | 3 | 7 | 3.4 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3noc(O)n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
CHEMBL351891 | 119691 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 4 | 3 | 7 | 3.4 | CN1C(=O)[C@@H](NC(=O)Nc2ccc(-c3noc(O)n3)cc2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00032a003 | ||
10673193 | 97692 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 506 | 6 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
CHEMBL273693 | 97692 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 506 | 6 | 2 | 5 | 5.3 | CC(C)Oc1cccc(-n2c(CNC(=O)Nc3ccc(Br)cc3)nc3ccccc3c2=O)c1 | 10.1016/S0960-894X(97)00108-X | ||
44572200 | 178763 | 0 | None | -14 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL473612 | 178763 | 0 | None | -14 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL475226 | 178763 | 0 | None | -14 | 2 | Human | 8.9 | pKd | = | 8.9 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
90663557 | 106215 | 0 | None | 6165 | 2 | Rat | 10.7 | pKi | = | 10.7 | Binding | ChEMBL | 1152 | 31 | 11 | 13 | 2.0 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NC(=O)c1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL3143672 | 106215 | 0 | None | 6165 | 2 | Rat | 10.7 | pKi | = | 10.7 | Binding | ChEMBL | 1152 | 31 | 11 | 13 | 2.0 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NC(=O)c1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
443375 | 205872 | 40 | None | -2 | 5 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm051219x | ||
CHEMBL9506 | 205872 | 40 | None | -2 | 5 | Human | 10.6 | pKi | = | 10.6 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm051219x | ||
10819755 | 164890 | 0 | None | 52480 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL423907 | 164890 | 0 | None | 52480 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
9919500 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL1161142 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL76248 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
9919500 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL1161142 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL76248 | 203217 | 1 | None | 7413 | 2 | Rat | 10.5 | pKi | = | 10.5 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
90662930 | 106089 | 0 | None | 3981 | 2 | Rat | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 1073 | 29 | 11 | 11 | 2.6 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NC(=O)c1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL3142366 | 106089 | 0 | None | 3981 | 2 | Rat | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 1073 | 29 | 11 | 11 | 2.6 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)NC(=O)c1ccccc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
44357046 | 27850 | 1 | None | 18 | 2 | Rat | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 1012 | 28 | 9 | 13 | 0.7 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL137280 | 27850 | 1 | None | 18 | 2 | Rat | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 1012 | 28 | 9 | 13 | 0.7 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970477u | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970477u | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970477u | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970477u | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm970477u | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 10.1 | pKi | = | 10.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
108187 | 913 | 30 | None | 4 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm990967h | ||
873 | 913 | 30 | None | 4 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm990967h | ||
CHEMBL2062154 | 913 | 30 | None | 4 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm990967h | ||
CHEMBL287735 | 913 | 30 | None | 4 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm990967h | ||
5311201 | 205663 | 30 | None | 26 | 6 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL9387 | 205663 | 30 | None | 26 | 6 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm990967h | ||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
11804040 | 118943 | 0 | None | 2137 | 2 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL345049 | 118943 | 0 | None | 2137 | 2 | Rat | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 976 | 28 | 9 | 11 | 1.6 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
10581797 | 62914 | 0 | None | 9120 | 2 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 976 | 26 | 9 | 11 | 1.3 | CC[C@H](C)[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/jm970477u | ||
CHEMBL1791002 | 62914 | 0 | None | 9120 | 2 | Rat | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 976 | 26 | 9 | 11 | 1.3 | CC[C@H](C)[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/jm970477u | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm8007618 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9603072 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9603072 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9603072 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9603072 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9603072 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
121964 | 205 | 28 | None | 831 | 2 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
858 | 205 | 28 | None | 831 | 2 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
CHEMBL323521 | 205 | 28 | None | 831 | 2 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm990252e | ||||
14208194 | 162884 | 2 | None | 1122 | 2 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9703247 | ||
CHEMBL419764 | 162884 | 2 | None | 1122 | 2 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm9703247 | ||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2003.11.001 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2003.11.001 | ||||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9703247 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9703247 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9703247 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9703247 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | None | 10.1021/jm9703247 | ||||
10701167 | 62915 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 990 | 27 | 8 | 11 | 1.8 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/jm970477u | ||
CHEMBL1791005 | 62915 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 990 | 27 | 8 | 11 | 1.8 | CCCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N(C)[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC | 10.1021/jm970477u | ||
CHEMBL2115177 | 207516 | 0 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
10507071 | 113111 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
CHEMBL332261 | 113111 | 0 | None | - | 1 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00126a007 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00126a007 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00126a007 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00126a007 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00126a007 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80678-2 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80678-2 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80678-2 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1016/S0960-894X(00)80678-2 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00122a026 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0000416 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0000416 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0000416 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0000416 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0000416 | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00053a022 | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00053a022 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00053a022 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00053a022 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00053a022 | ||||
443375 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00084a009 | ||
CHEMBL9506 | 205872 | 40 | None | -3 | 5 | Rat | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm00084a009 | ||
5311400 | 3241 | 1 | None | -2 | 3 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
900 | 3241 | 1 | None | -2 | 3 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
CHEMBL262197 | 3241 | 1 | None | -2 | 3 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.11.001 | ||||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
44357045 | 26370 | 0 | None | 85 | 2 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1012 | 28 | 9 | 13 | 0.7 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL136096 | 26370 | 0 | None | 85 | 2 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 1012 | 28 | 9 | 13 | 0.7 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL2369815 | 207948 | 0 | None | 85 | 2 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CSCC[C@@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||||
10557073 | 16196 | 0 | None | 3467 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 763 | 20 | 7 | 8 | 2.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C | 10.1021/jm0000416 | ||
CHEMBL122934 | 16196 | 0 | None | 3467 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 763 | 20 | 7 | 8 | 2.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C | 10.1021/jm0000416 | ||
10004216 | 4675 | 0 | None | -11 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL103750 | 4675 | 0 | None | -11 | 2 | Rat | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL1172429 | 206845 | 0 | None | 26 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
44359425 | 14575 | 0 | None | - | 1 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL1206331 | 14575 | 0 | None | - | 1 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL262687 | 14575 | 0 | None | - | 1 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
443375 | 205872 | 40 | None | -2 | 5 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL9506 | 205872 | 40 | None | -2 | 5 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c2ccccc2)c2ccccc21 | 10.1016/j.bmcl.2007.09.093 | ||
44328894 | 108137 | 0 | None | -25 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 587 | 5 | 2 | 4 | 4.8 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CC(=O)N2CC3CCC(CC3)C2)c2ccccc2N(c2ccccc2F)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
CHEMBL320624 | 108137 | 0 | None | -25 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 587 | 5 | 2 | 4 | 4.8 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CC(=O)N2CC3CCC(CC3)C2)c2ccccc2N(c2ccccc2F)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
3476 | 1373 | 8 | None | 2 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm200438b | ||
59751 | 1373 | 8 | None | 2 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm200438b | ||
878 | 1373 | 8 | None | 2 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm200438b | ||
CHEMBL39263 | 1373 | 8 | None | 2 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 10.1021/jm200438b | ||
10840582 | 167416 | 0 | None | 257 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
CHEMBL431858 | 167416 | 0 | None | 257 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
45486933 | 195261 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 520 | 7 | 2 | 6 | 5.3 | CC(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL566360 | 195261 | 0 | None | 3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 520 | 7 | 2 | 6 | 5.3 | CC(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.064 | ||
45487006 | 197234 | 0 | None | -10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 666 | 8 | 3 | 6 | 5.0 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL584525 | 197234 | 0 | None | -10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 666 | 8 | 3 | 6 | 5.0 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
10767708 | 14377 | 0 | None | -138 | 2 | Rat | 7.0 | pKi | = | 7 | Binding | ChEMBL | 500 | 6 | 2 | 3 | 5.6 | O=C(Nc1ccccc1)NC1C(=O)N(CCC2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1021/jm990967h | ||
CHEMBL120296 | 14377 | 0 | None | -138 | 2 | Rat | 7.0 | pKi | = | 7 | Binding | ChEMBL | 500 | 6 | 2 | 3 | 5.6 | O=C(Nc1ccccc1)NC1C(=O)N(CCC2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1021/jm990967h | ||
45486994 | 196047 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 506 | 7 | 2 | 6 | 4.8 | O=C(NCCc1ccc(Cl)cc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL571457 | 196047 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 506 | 7 | 2 | 6 | 4.8 | O=C(NCCc1ccc(Cl)cc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
44408411 | 160763 | 0 | None | -2089 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 1242 | 31 | 11 | 15 | 4.4 | CCCC[C@@H](C(=O)N[C@@H](Cc1cn(C(C)=O)c2ccccc12)C(=O)O)N(C(=O)Nc1ccccc1Cl)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)N(C)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
CHEMBL412331 | 160763 | 0 | None | -2089 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 1242 | 31 | 11 | 15 | 4.4 | CCCC[C@@H](C(=O)N[C@@H](Cc1cn(C(C)=O)c2ccccc12)C(=O)O)N(C(=O)Nc1ccccc1Cl)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)N(C)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
118719285 | 114984 | 0 | None | -25 | 3 | Guinea pig | 6.0 | pKi | = | 6 | Binding | ChEMBL | 733 | 15 | 5 | 7 | 4.7 | CN(C)[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)c1ccccc1 | 10.1021/jm00053a022 | ||
CHEMBL3351057 | 114984 | 0 | None | -25 | 3 | Guinea pig | 6.0 | pKi | = | 6 | Binding | ChEMBL | 733 | 15 | 5 | 7 | 4.7 | CN(C)[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)c1ccccc1 | 10.1021/jm00053a022 | ||
44265924 | 205649 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6 | Binding | ChEMBL | 363 | 5 | 1 | 1 | 5.7 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1cccc2ccccc12 | 10.1021/jm00084a009 | ||
CHEMBL9379 | 205649 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6 | Binding | ChEMBL | 363 | 5 | 1 | 1 | 5.7 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1cccc2ccccc12 | 10.1021/jm00084a009 | ||
10440219 | 168133 | 0 | None | -25 | 2 | Guinea pig | 6.0 | pKi | = | 6 | Binding | ChEMBL | 776 | 15 | 6 | 7 | 4.4 | CN(C)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)c1ccccc1 | 10.1016/S0960-894X(00)80678-2 | ||
CHEMBL436722 | 168133 | 0 | None | -25 | 2 | Guinea pig | 6.0 | pKi | = | 6 | Binding | ChEMBL | 776 | 15 | 6 | 7 | 4.4 | CN(C)C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)c1ccccc1 | 10.1016/S0960-894X(00)80678-2 | ||
11527738 | 75636 | 0 | None | -10964 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 518 | 7 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL205455 | 75636 | 0 | None | -10964 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 518 | 7 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL411201 | 211125 | 0 | None | -4786 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm0303103 | ||||
44408484 | 136983 | 0 | None | -19498 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 1033 | 30 | 13 | 12 | 1.4 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL375412 | 136983 | 0 | None | -19498 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 1033 | 30 | 13 | 12 | 1.4 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
44418924 | 156340 | 0 | None | -19952 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](N)Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL407198 | 156340 | 0 | None | -19952 | 4 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](N)Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
9844256 | 11692 | 0 | None | -3 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 406 | 7 | 3 | 2 | 4.6 | O=C(O)CCNC(=O)c1cc(-c2ccccc2)[nH]c1CC12CC3CC(CC(C3)C1)C2 | 10.1021/jm049069y | ||
CHEMBL1181869 | 11692 | 0 | None | -3 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 406 | 7 | 3 | 2 | 4.6 | O=C(O)CCNC(=O)c1cc(-c2ccccc2)[nH]c1CC12CC3CC(CC(C3)C1)C2 | 10.1021/jm049069y | ||
CHEMBL2067947 | 11692 | 0 | None | -3 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 406 | 7 | 3 | 2 | 4.6 | O=C(O)CCNC(=O)c1cc(-c2ccccc2)[nH]c1CC12CC3CC(CC(C3)C1)C2 | 10.1021/jm049069y | ||
44403980 | 11700 | 0 | None | -398 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(C(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1181938 | 11700 | 0 | None | -398 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(C(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067951 | 11700 | 0 | None | -398 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(C(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
10771043 | 25948 | 0 | None | -61 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm00021a019 | ||
CHEMBL135658 | 25948 | 0 | None | -61 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm00021a019 | ||
44212464 | 63807 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 527 | 8 | 2 | 5 | 3.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808399 | 63807 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 527 | 8 | 2 | 5 | 3.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
56673524 | 63824 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808418 | 63824 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
10438352 | 9706 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 588 | 8 | 3 | 6 | 3.9 | COC(=O)[C@@]1(Cc2ccccc2)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm9703247 | ||
CHEMBL113699 | 9706 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 588 | 8 | 3 | 6 | 3.9 | COC(=O)[C@@]1(Cc2ccccc2)C[C@@H]2[C@@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C)CCCN2C1=O | 10.1021/jm9703247 | ||
10054705 | 107941 | 0 | None | -28 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 625 | 10 | 3 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL319880 | 107941 | 0 | None | -28 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 625 | 10 | 3 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
44357069 | 155152 | 0 | None | -147 | 2 | Guinea pig | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 675 | 9 | 5 | 5 | 5.4 | C[C@@H](NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL405062 | 155152 | 0 | None | -147 | 2 | Guinea pig | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 675 | 9 | 5 | 5 | 5.4 | C[C@@H](NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10077166 | 99472 | 0 | None | -75 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
CHEMBL286247 | 99472 | 0 | None | -75 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
44280157 | 155188 | 0 | None | -75 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 667 | 8 | 3 | 5 | 6.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2Cl)C[C@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
CHEMBL405468 | 155188 | 0 | None | -75 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 667 | 8 | 3 | 5 | 6.9 | C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2Cl)C[C@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
10257865 | 206696 | 3 | None | -173 | 5 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99939 | 206696 | 3 | None | -173 | 5 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
56683505 | 63810 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 571 | 8 | 2 | 5 | 3.7 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(Br)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808402 | 63810 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 571 | 8 | 2 | 5 | 3.7 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(Br)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL430298 | 211870 | 0 | None | -2137 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm0303103 | ||||
44331483 | 107012 | 0 | None | -25 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 541 | 5 | 1 | 4 | 6.1 | O=C(NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O)Oc1ccccc1 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL318569 | 107012 | 0 | None | -25 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 541 | 5 | 1 | 4 | 6.1 | O=C(NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O)Oc1ccccc1 | 10.1016/S0960-894X(96)00544-6 | ||
10840039 | 113294 | 0 | None | -16 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 534 | 6 | 2 | 4 | 6.2 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL332403 | 113294 | 0 | None | -16 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 534 | 6 | 2 | 4 | 6.2 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL218327 | 207649 | 0 | None | -2630 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
CHEMBL1207511 | 206867 | 0 | None | -2398 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL412917 | 206867 | 0 | None | -2398 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL353862 | 209981 | 0 | None | -77 | 3 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O)c1ccccc1 | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL3350335 | 209728 | 0 | None | -245 | 2 | Guinea pig | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
10626579 | 15336 | 0 | None | -38 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 554 | 6 | 2 | 4 | 6.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(OC(F)(F)F)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL121703 | 15336 | 0 | None | -38 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 554 | 6 | 2 | 4 | 6.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(OC(F)(F)F)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
10552321 | 163358 | 0 | None | -165 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 470 | 5 | 2 | 3 | 5.3 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL420728 | 163358 | 0 | None | -165 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 470 | 5 | 2 | 3 | 5.3 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
11698512 | 167692 | 0 | None | -21 | 3 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 435 | 8 | 3 | 3 | 5.5 | CCCc1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL433776 | 167692 | 0 | None | -21 | 3 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 435 | 8 | 3 | 3 | 5.5 | CCCc1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
3503 | 1862 | 8 | None | -1174 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(N[C@H]1C(=O)N(c2ccccc2)c2c(N(C1=O)CC13CC4CC(C3)CC(C1)C4)cccc2)Nc1ccccc1 | 10.1016/S0960-894X(96)00544-6 | ||
5311147 | 1862 | 8 | None | -1174 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(N[C@H]1C(=O)N(c2ccccc2)c2c(N(C1=O)CC13CC4CC(C3)CC(C1)C4)cccc2)Nc1ccccc1 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL329305 | 1862 | 8 | None | -1174 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(N[C@H]1C(=O)N(c2ccccc2)c2c(N(C1=O)CC13CC4CC(C3)CC(C1)C4)cccc2)Nc1ccccc1 | 10.1016/S0960-894X(96)00544-6 | ||
44346296 | 113999 | 0 | None | -1174 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 562 | 6 | 2 | 4 | 5.9 | O=Cc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL333517 | 113999 | 0 | None | -1174 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 562 | 6 | 2 | 4 | 5.9 | O=Cc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
11527738 | 75636 | 0 | None | -10964 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 518 | 7 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
CHEMBL205455 | 75636 | 0 | None | -10964 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 518 | 7 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
10257865 | 206696 | 3 | None | -173 | 5 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99939 | 206696 | 3 | None | -173 | 5 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
10576324 | 113465 | 0 | None | -54 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.3 | CC(C)CC(C)N1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL332595 | 113465 | 0 | None | -54 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.3 | CC(C)CC(C)N1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
135529065 | 156473 | 0 | None | -275 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 588 | 7 | 2 | 7 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL407340 | 156473 | 0 | None | -275 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 588 | 7 | 2 | 7 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
11511721 | 75749 | 0 | None | -194 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 502 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)C[C@@H]2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
CHEMBL205751 | 75749 | 0 | None | -194 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 502 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)C[C@@H]2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
10618720 | 192896 | 0 | None | -4 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 363 | 4 | 2 | 2 | 4.5 | O=C(O)c1cc2ccccc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm9508907 | ||
CHEMBL52740 | 192896 | 0 | None | -4 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 363 | 4 | 2 | 2 | 4.5 | O=C(O)c1cc2ccccc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm9508907 | ||
CHEMBL64605 | 214079 | 6 | None | -1288 | 3 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0000416 | ||||
11635377 | 197131 | 0 | None | 39 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 554 | 7 | 2 | 6 | 6.0 | CC(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL583457 | 197131 | 0 | None | 39 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 554 | 7 | 2 | 6 | 6.0 | CC(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2009.09.064 | ||
44346047 | 112903 | 0 | None | -537 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 568 | 7 | 2 | 7 | 6.4 | O=C(Nc1cccc(C2N=NN=N2)c1)NC1C(=O)N(CCC2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1021/jm990967h | ||
CHEMBL331872 | 112903 | 0 | None | -537 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 568 | 7 | 2 | 7 | 6.4 | O=C(Nc1cccc(C2N=NN=N2)c1)NC1C(=O)N(CCC2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1021/jm990967h | ||
CHEMBL3351051 | 209789 | 0 | None | -17 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cccc2ccccc12)NC)C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
CHEMBL3351053 | 209791 | 0 | None | -426 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
44356886 | 28215 | 0 | None | -42 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 757 | 11 | 5 | 5 | 7.3 | O=C(O)c1cc(NC(=O)[C@@H](CC2CCCCC2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL137525 | 28215 | 0 | None | -42 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 757 | 11 | 5 | 5 | 7.3 | O=C(O)c1cc(NC(=O)[C@@H](CC2CCCCC2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10747345 | 116477 | 0 | None | -6 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1ccccc1NC(=O)[C@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
CHEMBL338728 | 116477 | 0 | None | -6 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1ccccc1NC(=O)[C@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
44329798 | 107063 | 0 | None | -100 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 610 | 10 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(C(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL318852 | 107063 | 0 | None | -100 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 610 | 10 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(C(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
11497371 | 70286 | 0 | None | -40 | 3 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 525 | 7 | 3 | 3 | 7.4 | Cc1cc(C)c(-c2nc(C(=O)Nc3ccc(C)c(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
CHEMBL195007 | 70286 | 0 | None | -40 | 3 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 525 | 7 | 3 | 3 | 7.4 | Cc1cc(C)c(-c2nc(C(=O)Nc3ccc(C)c(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
10552320 | 116956 | 0 | None | -109 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.2 | CC(C)C(C)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL339879 | 116956 | 0 | None | -109 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.2 | CC(C)C(C)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
10257865 | 206696 | 3 | None | -204 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99939 | 206696 | 3 | None | -204 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
9960432 | 39187 | 6 | None | -12 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL147186 | 39187 | 6 | None | -12 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 605 | 8 | 3 | 5 | 5.0 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
11571140 | 71357 | 0 | None | -23 | 3 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 489 | 7 | 3 | 3 | 6.9 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL196517 | 71357 | 0 | None | -23 | 3 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 489 | 7 | 3 | 3 | 6.9 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
45487002 | 195912 | 0 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 672 | 8 | 3 | 7 | 5.1 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL570520 | 195912 | 0 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 672 | 8 | 3 | 7 | 5.1 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
9958214 | 114295 | 0 | None | -269 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL333979 | 114295 | 0 | None | -269 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
44272156 | 141010 | 0 | None | -45 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL384731 | 141010 | 0 | None | -45 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
44444933 | 94230 | 0 | None | - | 1 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 455 | 6 | 3 | 3 | 5.8 | O=C(O)c1cccc(NC(=O)c2nc(-c3ccccc3)[nH]c2CC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm070880t | ||
CHEMBL252559 | 94230 | 0 | None | - | 1 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 455 | 6 | 3 | 3 | 5.8 | O=C(O)c1cccc(NC(=O)c2nc(-c3ccccc3)[nH]c2CC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm070880t | ||
9853208 | 101254 | 0 | None | -1071 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 710 | 11 | 6 | 9 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2[nH]ccc2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
CHEMBL299540 | 101254 | 0 | None | -1071 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 710 | 11 | 6 | 9 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2[nH]ccc2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
44346825 | 114275 | 0 | None | -77 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
CHEMBL333920 | 114275 | 0 | None | -77 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
3960 | 2313 | 20 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm950423p | ||
891 | 2313 | 20 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm950423p | ||
CHEMBL24938 | 2313 | 20 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCCC | 10.1021/jm950423p | ||
16100406 | 82811 | 0 | None | -33 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL218600 | 82811 | 0 | None | -33 | 4 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
11612498 | 133039 | 0 | None | -5 | 3 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 469 | 7 | 3 | 3 | 6.2 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccccc3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL371068 | 133039 | 0 | None | -5 | 3 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 469 | 7 | 3 | 3 | 6.2 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccccc3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
9808153 | 112177 | 0 | None | -36 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL330390 | 112177 | 0 | None | -36 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 571 | 11 | 3 | 4 | 5.6 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCC(=O)O)CCc1ccccc1 | 10.1021/jm00072a005 | ||
10676550 | 118857 | 0 | None | -12 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm00021a019 | ||
CHEMBL344396 | 118857 | 0 | None | -12 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm00021a019 | ||
10257865 | 206696 | 3 | None | -204 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99939 | 206696 | 3 | None | -204 | 5 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 591 | 10 | 3 | 4 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1)CC(=O)O | 10.1021/jm00072a005 | ||
44271859 | 140993 | 0 | None | -4 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 1292 | 39 | 14 | 16 | 2.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL384618 | 140993 | 0 | None | -4 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 1292 | 39 | 14 | 16 | 2.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL1172251 | 206841 | 0 | None | -229 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
CHEMBL3351058 | 209794 | 0 | None | -83 | 2 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)C1CCCCC1 | 10.1021/jm00053a022 | ||||
44265978 | 205767 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 365 | 6 | 2 | 2 | 5.3 | O=C(NCCN(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
CHEMBL9444 | 205767 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 365 | 6 | 2 | 2 | 5.3 | O=C(NCCN(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
CHEMBL2370437 | 208105 | 0 | None | -10 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
10745516 | 14242 | 0 | None | -60 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 563 | 5 | 2 | 4 | 5.8 | CN(C)c1cccc(NC(=O)NC2C(=O)N(c3ccccc3)c3ccccc3N(C3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL120015 | 14242 | 0 | None | -60 | 2 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 563 | 5 | 2 | 4 | 5.8 | CN(C)c1cccc(NC(=O)NC2C(=O)N(c3ccccc3)c3ccccc3N(C3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)C2=O)c1 | 10.1021/jm990967h | ||
56673524 | 63824 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808418 | 63824 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
44331467 | 106967 | 0 | None | -41 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 529 | 7 | 1 | 4 | 5.8 | CC(C)CCN1C(=O)C(NC(=O)Oc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL318291 | 106967 | 0 | None | -41 | 2 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 529 | 7 | 1 | 4 | 5.8 | CC(C)CCN1C(=O)C(NC(=O)Oc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
44357057 | 118715 | 0 | None | -446 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccccc2F)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL343367 | 118715 | 0 | None | -446 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccccc2F)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10794262 | 168063 | 0 | None | -6 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 4.8 | O=C(O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
CHEMBL436175 | 168063 | 0 | None | -6 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 4.8 | O=C(O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
11539356 | 71336 | 0 | None | -69 | 3 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 435 | 7 | 3 | 3 | 5.6 | CC(C)c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL196441 | 71336 | 0 | None | -69 | 3 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 435 | 7 | 3 | 3 | 5.6 | CC(C)c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
56683506 | 63811 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 511 | 8 | 2 | 5 | 3.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(F)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808403 | 63811 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 511 | 8 | 2 | 5 | 3.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(F)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
19700629 | 63809 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 561 | 8 | 2 | 5 | 4.0 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(C(F)(F)F)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808401 | 63809 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 561 | 8 | 2 | 5 | 4.0 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(C(F)(F)F)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
10770670 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL2067959 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL24313 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
9850043 | 112375 | 1 | None | -446 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL330977 | 112375 | 1 | None | -446 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44346826 | 113315 | 0 | None | -69 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 3.9 | O=C(O)CNC(=O)[C@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL332510 | 113315 | 0 | None | -69 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 3.9 | O=C(O)CNC(=O)[C@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL334114 | 209648 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)N | 10.1021/jm0000416 | ||||
CHEMBL2372623 | 208532 | 0 | None | -16 | 4 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
CHEMBL2370598 | 208133 | 0 | None | -12 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
44385472 | 81714 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 1246 | 26 | 13 | 15 | 2.2 | CCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCNC(=O)CC(NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CN)Cc1ccccc1 | 10.1021/jm00389a002 | ||
CHEMBL216677 | 81714 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 1246 | 26 | 13 | 15 | 2.2 | CCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCNC(=O)CC(NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CN)Cc1ccccc1 | 10.1021/jm00389a002 | ||
19700643 | 63688 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1807152 | 63688 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
11712880 | 138394 | 0 | None | -114 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
CHEMBL378388 | 138394 | 0 | None | -114 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 490 | 6 | 2 | 5 | 5.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
10769748 | 112508 | 0 | None | -1148 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 591 | 6 | 3 | 4 | 6.1 | CC(=O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331119 | 112508 | 0 | None | -1148 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 591 | 6 | 3 | 4 | 6.1 | CC(=O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
10482868 | 106920 | 0 | None | -107 | 5 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL317999 | 106920 | 0 | None | -107 | 5 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
10460621 | 106694 | 0 | None | -8 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 567 | 8 | 3 | 3 | 6.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)c(Cl)c1 | 10.1021/jm00072a005 | ||
CHEMBL316462 | 106694 | 0 | None | -8 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 567 | 8 | 3 | 3 | 6.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)c(Cl)c1 | 10.1021/jm00072a005 | ||
44451877 | 95535 | 0 | None | -162 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 587 | 7 | 1 | 6 | 6.9 | Cc1nc(-c2cccc(NC(=O)CN3C(=O)N(CC(=O)C(C)(C)C)c4ccccc4N(C4CCCCC4)C3=O)c2)cs1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL259557 | 95535 | 0 | None | -162 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 587 | 7 | 1 | 6 | 6.9 | Cc1nc(-c2cccc(NC(=O)CN3C(=O)N(CC(=O)C(C)(C)C)c4ccccc4N(C4CCCCC4)C3=O)c2)cs1 | 10.1016/j.bmc.2007.12.047 | ||
10722460 | 15023 | 0 | None | -309 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1cccc(Br)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL121028 | 15023 | 0 | None | -309 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1cccc(Br)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL440259 | 212114 | 0 | None | -4 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](CCC(=O)O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
44318341 | 204281 | 0 | None | -501 | 3 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 698 | 10 | 5 | 5 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
CHEMBL1628582 | 204281 | 0 | None | -501 | 3 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 698 | 10 | 5 | 5 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
CHEMBL84864 | 204281 | 0 | None | -501 | 3 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 698 | 10 | 5 | 5 | 5.4 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
10698109 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL317181 | 106812 | 0 | None | 5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 560 | 8 | 1 | 4 | 5.8 | CC(C)N(C(=O)CN1C(=O)C(CC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
45486967 | 195747 | 0 | None | 39 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 472 | 7 | 2 | 6 | 4.1 | O=C(NCCc1ccccc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL569616 | 195747 | 0 | None | 39 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 472 | 7 | 2 | 6 | 4.1 | O=C(NCCc1ccccc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45102806 | 195088 | 0 | None | -15 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 646 | 8 | 3 | 7 | 5.1 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL565324 | 195088 | 0 | None | -15 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 646 | 8 | 3 | 7 | 5.1 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
45486936 | 195296 | 0 | None | -25 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 640 | 8 | 3 | 6 | 5.1 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL566574 | 195296 | 0 | None | -25 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 640 | 8 | 3 | 6 | 5.1 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
11700410 | 197077 | 0 | None | -31 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 704 | 8 | 3 | 7 | 4.4 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(I)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL583035 | 197077 | 0 | None | -31 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 704 | 8 | 3 | 7 | 4.4 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(I)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
9872866 | 63822 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 571 | 7 | 2 | 5 | 4.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808416 | 63822 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 571 | 7 | 2 | 5 | 4.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
44212230 | 4195 | 0 | None | -208 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 572 | 8 | 1 | 5 | 5.9 | CC(C)CCN1C(=O)C(NC(=O)Oc2cccc(N(C)C)c2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL100509 | 4195 | 0 | None | -208 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 572 | 8 | 1 | 5 | 5.9 | CC(C)CCN1C(=O)C(NC(=O)Oc2cccc(N(C)C)c2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
10792765 | 112581 | 0 | None | -2754 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 550 | 5 | 3 | 4 | 5.8 | O=C(Nc1cccc(O)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL331244 | 112581 | 0 | None | -2754 | 2 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 550 | 5 | 3 | 4 | 5.8 | O=C(Nc1cccc(O)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
10770670 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067959 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL24313 | 92061 | 0 | None | -301 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 663 | 11 | 6 | 6 | 4.9 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
44359447 | 14534 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL1206132 | 14534 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL217767 | 14534 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL216831 | 207598 | 0 | None | -29 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCC)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](CCC(=O)O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
10482233 | 167639 | 0 | None | -41 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 533 | 8 | 3 | 3 | 6.0 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)cc1 | 10.1021/jm00072a005 | ||
CHEMBL433407 | 167639 | 0 | None | -41 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 533 | 8 | 3 | 3 | 6.0 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)cc1 | 10.1021/jm00072a005 | ||
10795116 | 27707 | 0 | None | -602 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 743 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCc2ccc3ccccc3c2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL137180 | 27707 | 0 | None | -602 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 743 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCc2ccc3ccccc3c2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
9850043 | 112375 | 1 | None | -446 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL330977 | 112375 | 1 | None | -446 | 3 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
44356826 | 118801 | 0 | None | -19 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 781 | 12 | 5 | 6 | 6.6 | COc1ccc(C[C@@H](NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)cc1 | 10.1021/jm00021a019 | ||
CHEMBL344014 | 118801 | 0 | None | -19 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 781 | 12 | 5 | 6 | 6.6 | COc1ccc(C[C@@H](NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)cc1 | 10.1021/jm00021a019 | ||
56666598 | 63828 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 575 | 9 | 2 | 4 | 5.3 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccc(F)cc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808422 | 63828 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 575 | 9 | 2 | 4 | 5.3 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccc(F)cc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
16733645 | 13070 | 0 | None | -416 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 598 | 9 | 2 | 7 | 5.4 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3cn(CC(=O)O)cn3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL1190962 | 13070 | 0 | None | -416 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 598 | 9 | 2 | 7 | 5.4 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3cn(CC(=O)O)cn3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL541903 | 13070 | 0 | None | -416 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 598 | 9 | 2 | 7 | 5.4 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3cn(CC(=O)O)cn3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44280114 | 5041 | 0 | None | 1 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/s0960-894x(98)00231-5 | ||
CHEMBL105618 | 5041 | 0 | None | 1 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 567 | 7 | 2 | 4 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N1CCC(C(=O)c2ccccc2)CC1 | 10.1016/s0960-894x(98)00231-5 | ||
44572200 | 178763 | 0 | None | -14 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL473612 | 178763 | 0 | None | -14 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL475226 | 178763 | 0 | None | -14 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
56659685 | 63821 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 3.8 | Cc1cccc(NC(=O)NC2C(=O)N(CCN3CCOCC3)c3ccccc3N(CC3CCCCC3)C2=O)c1 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808415 | 63821 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 533 | 7 | 2 | 5 | 3.8 | Cc1cccc(NC(=O)NC2C(=O)N(CCN3CCOCC3)c3ccccc3N(CC3CCCCC3)C2=O)c1 | 10.1016/j.bmc.2011.05.057 | ||
5311201 | 205663 | 30 | None | -1174 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm051219x | ||
CHEMBL9387 | 205663 | 30 | None | -1174 | 6 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm051219x | ||
16732019 | 85009 | 0 | None | -1737 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 542 | 7 | 2 | 7 | 4.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL226533 | 85009 | 0 | None | -1737 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 542 | 7 | 2 | 7 | 4.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
54045469 | 63818 | 0 | None | - | 1 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 481 | 9 | 2 | 5 | 3.2 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN(C)C)C2=O)cc1 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808412 | 63818 | 0 | None | - | 1 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 481 | 9 | 2 | 5 | 3.2 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN(C)C)C2=O)cc1 | 10.1016/j.bmc.2011.05.057 | ||
10258121 | 98121 | 0 | None | 11 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 606 | 11 | 4 | 2 | 7.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL276676 | 98121 | 0 | None | 11 | 2 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 606 | 11 | 4 | 2 | 7.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL59865 | 214039 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN | 10.1021/jm0000416 | ||||
CHEMBL1172253 | 206843 | 0 | None | -138 | 4 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
44265911 | 205404 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 276 | 4 | 2 | 1 | 3.6 | O=C(NC/C=C/c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
CHEMBL9220 | 205404 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 276 | 4 | 2 | 1 | 3.6 | O=C(NC/C=C/c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
10004216 | 4675 | 0 | None | -11 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL103750 | 4675 | 0 | None | -11 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
44356887 | 31102 | 0 | None | -776 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 757 | 11 | 5 | 6 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccsc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL140179 | 31102 | 0 | None | -776 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 757 | 11 | 5 | 6 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccsc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10323690 | 100032 | 0 | None | -21 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL2114401 | 100032 | 0 | None | -21 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL291033 | 100032 | 0 | None | -21 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 499 | 8 | 3 | 3 | 5.4 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
44272076 | 168244 | 0 | None | -407 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)[C@H](NC(=O)OC(C)(C)C)CCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL437661 | 168244 | 0 | None | -407 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)[C@H](NC(=O)OC(C)(C)C)CCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
10819816 | 118236 | 0 | None | 7 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 998 | 28 | 10 | 13 | 0.4 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
CHEMBL341762 | 118236 | 0 | None | 7 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 998 | 28 | 10 | 13 | 0.4 | CSCC[C@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm970477u | ||
73354497 | 88955 | 0 | None | 7 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 998 | 28 | 10 | 13 | 0.4 | CSCC[C@@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL2369817 | 88955 | 0 | None | 7 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 998 | 28 | 10 | 13 | 0.4 | CSCC[C@@H](NC(=O)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCSC)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
44359447 | 14534 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL1206132 | 14534 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL217767 | 14534 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
10768579 | 113367 | 0 | None | -32 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 531 | 6 | 2 | 4 | 5.5 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL332568 | 113367 | 0 | None | -32 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 531 | 6 | 2 | 4 | 5.5 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10722460 | 15023 | 0 | None | -309 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1cccc(Br)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL121028 | 15023 | 0 | None | -309 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1cccc(Br)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44408526 | 136422 | 0 | None | -2344 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1148 | 30 | 11 | 15 | 3.0 | CCCC[C@@H](C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O)N(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
CHEMBL374325 | 136422 | 0 | None | -2344 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1148 | 30 | 11 | 15 | 3.0 | CCCC[C@@H](C(=O)N[C@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O)N(C)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O | 10.1021/jm050851n | ||
16100409 | 82821 | 0 | None | -870 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL218651 | 82821 | 0 | None | -870 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
16732916 | 136430 | 0 | None | -338 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 596 | 8 | 2 | 5 | 6.3 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C23CC4CC(CC(C4)C2)C3)C1=O)Nc1cccc(C(=O)O)c1 | 10.1021/jm070139l | ||
CHEMBL374388 | 136430 | 0 | None | -338 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 596 | 8 | 2 | 5 | 6.3 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C23CC4CC(CC(C4)C2)C3)C1=O)Nc1cccc(C(=O)O)c1 | 10.1021/jm070139l | ||
10695854 | 113504 | 0 | None | -25 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL332646 | 113504 | 0 | None | -25 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
45486955 | 195722 | 0 | None | -5 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 628 | 8 | 3 | 7 | 5.0 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL569470 | 195722 | 0 | None | -5 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 628 | 8 | 3 | 7 | 5.0 | O=C(N[C@@H](Cc1ccc(Cl)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486969 | 195794 | 0 | None | 7 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 598 | 8 | 3 | 7 | 5.4 | C[C@H](c1ccc(Cl)c(Cl)c1)[C@@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL569849 | 195794 | 0 | None | 7 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 598 | 8 | 3 | 7 | 5.4 | C[C@H](c1ccc(Cl)c(Cl)c1)[C@@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
45486947 | 195227 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 654 | 8 | 2 | 7 | 5.2 | COC(=O)[C@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL566177 | 195227 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 654 | 8 | 2 | 7 | 5.2 | COC(=O)[C@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
11693225 | 197123 | 0 | None | -7 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 676 | 8 | 3 | 7 | 4.8 | O=C(N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(I)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL583344 | 197123 | 0 | None | -7 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 676 | 8 | 3 | 7 | 4.8 | O=C(N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(I)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
16090700 | 82051 | 0 | None | 10 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 541 | 8 | 4 | 4 | 4.2 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
CHEMBL217595 | 82051 | 0 | None | 10 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 541 | 8 | 4 | 4 | 4.2 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
9958214 | 114295 | 0 | None | -269 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL333979 | 114295 | 0 | None | -269 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
45486995 | 196124 | 0 | None | -1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 486 | 8 | 2 | 6 | 4.5 | O=C(NCCCc1ccccc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL572046 | 196124 | 0 | None | -1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 486 | 8 | 2 | 6 | 4.5 | O=C(NCCCc1ccccc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486940 | 197207 | 0 | None | -31 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 550 | 8 | 3 | 7 | 4.2 | O=C(N[C@@H](Cc1ccc(Cl)cc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL584259 | 197207 | 0 | None | -31 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 550 | 8 | 3 | 7 | 4.2 | O=C(N[C@@H](Cc1ccc(Cl)cc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
44444929 | 94442 | 0 | None | - | 1 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 788 | 11 | 6 | 5 | 6.1 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccc(I)cc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL254020 | 94442 | 0 | None | - | 1 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 788 | 11 | 6 | 5 | 6.1 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccc(I)cc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
10795162 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL2067970 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL342616 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
16090702 | 165645 | 0 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 461 | 4 | 2 | 3 | 4.4 | O=C(c1ccc(Br)cc1NS(=O)(=O)c1cc2ccccc2[nH]1)N1CCCCC1 | 10.1021/jm060590x | ||
CHEMBL426524 | 165645 | 0 | None | 1 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 461 | 4 | 2 | 3 | 4.4 | O=C(c1ccc(Br)cc1NS(=O)(=O)c1cc2ccccc2[nH]1)N1CCCCC1 | 10.1021/jm060590x | ||
44331343 | 4345 | 0 | None | -57 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 606 | 6 | 2 | 3 | 7.0 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL101456 | 4345 | 0 | None | -57 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 606 | 6 | 2 | 3 | 7.0 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
44403984 | 12205 | 0 | None | -125 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(CC12CC3CC(CC(C3)C1)C2)C(=O)c1cc2[nH]cnc2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1185003 | 12205 | 0 | None | -125 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(CC12CC3CC(CC(C3)C1)C2)C(=O)c1cc2[nH]cnc2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067967 | 12205 | 0 | None | -125 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 5.2 | CN(CC12CC3CC(CC(C3)C1)C2)C(=O)c1cc2[nH]cnc2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
10795162 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067970 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL342616 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
6956374 | 2373 | 4 | None | - | 1 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm070880t | ||
902 | 2373 | 4 | None | - | 1 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm070880t | ||
CHEMBL117281 | 2373 | 4 | None | - | 1 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 435 | 3 | 2 | 2 | 4.9 | Brc1ccc(cc1)NC(=O)N1NC(=O)[C@@H]([C@H]1c1ccccc1)c1ccccc1 | 10.1021/jm070880t | ||
9939183 | 113629 | 0 | None | -6606 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 633 | 7 | 2 | 5 | 5.9 | O=C(Nc1cccc(CN2CCOCC2)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL332850 | 113629 | 0 | None | -6606 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 633 | 7 | 2 | 5 | 5.9 | O=C(Nc1cccc(CN2CCOCC2)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44347144 | 112567 | 0 | None | -12 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 512 | 6 | 2 | 4 | 4.0 | COC(=O)CNC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL331177 | 112567 | 0 | None | -12 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 512 | 6 | 2 | 4 | 4.0 | COC(=O)CNC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL386304 | 210633 | 0 | None | -6 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
44272056 | 97712 | 0 | None | -42 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL273880 | 97712 | 0 | None | -42 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 1194 | 24 | 13 | 13 | 2.6 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
10794634 | 112603 | 0 | None | 11220 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 677 | 19 | 7 | 7 | 0.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(N)=O | 10.1021/jm0000416 | ||
CHEMBL331394 | 112603 | 0 | None | 11220 | 2 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 677 | 19 | 7 | 7 | 0.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(N)=O | 10.1021/jm0000416 | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL333477 | 209646 | 0 | None | -3 | 3 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C | 10.1016/j.bmcl.2003.11.001 | ||||
CHEMBL333762 | 209647 | 0 | None | - | 1 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12 | 10.1021/jm0000416 | ||||
11216391 | 162941 | 0 | None | 1348 | 2 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 747 | 23 | 7 | 7 | 2.1 | CCCCCNC(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2003.11.001 | ||
CHEMBL420161 | 162941 | 0 | None | 1348 | 2 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 747 | 23 | 7 | 7 | 2.1 | CCCCCNC(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2003.11.001 | ||
CHEMBL119992 | 206856 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)N | 10.1021/jm0000416 | ||||
CHEMBL3350278 | 209720 | 0 | None | 20 | 2 | Guinea pig | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00174a016 | ||||
44265932 | 96554 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 420 | 5 | 2 | 1 | 6.3 | O=C(NCC=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
CHEMBL266596 | 96554 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 420 | 5 | 2 | 1 | 6.3 | O=C(NCC=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
44265967 | 164321 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 350 | 11 | 2 | 1 | 6.5 | CCCCCC(=CCNC(=O)Nc1ccc(Cl)cc1)CCCCC | 10.1021/jm00084a009 | ||
CHEMBL422036 | 164321 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 350 | 11 | 2 | 1 | 6.5 | CCCCCC(=CCNC(=O)Nc1ccc(Cl)cc1)CCCCC | 10.1021/jm00084a009 | ||
CHEMBL379405 | 210518 | 0 | None | -11 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
10099504 | 206472 | 0 | None | -14 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1cccc2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL98516 | 206472 | 0 | None | -14 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1cccc2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
10628607 | 116274 | 0 | None | -467 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 713 | 11 | 5 | 5 | 6.4 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL337673 | 116274 | 0 | None | -467 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 713 | 11 | 5 | 5 | 6.4 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
19700636 | 63816 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 491 | 8 | 2 | 4 | 4.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808410 | 63816 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 491 | 8 | 2 | 4 | 4.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
9872866 | 63822 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 571 | 7 | 2 | 5 | 4.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808416 | 63822 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 571 | 7 | 2 | 5 | 4.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
19700617 | 63827 | 0 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 4.7 | CN(C)CCCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808421 | 63827 | 0 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 4.7 | CN(C)CCCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
10370321 | 12873 | 0 | None | -30902 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 550 | 5 | 3 | 4 | 5.8 | O=C(Nc1ccc(O)cc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL118954 | 12873 | 0 | None | -30902 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 550 | 5 | 3 | 4 | 5.8 | O=C(Nc1ccc(O)cc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44346909 | 114085 | 0 | None | -10 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 498 | 6 | 3 | 3 | 3.9 | O=C(O)CNC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL333758 | 114085 | 0 | None | -10 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 498 | 6 | 3 | 3 | 3.9 | O=C(O)CNC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
44356888 | 118364 | 0 | None | -35 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 765 | 12 | 5 | 5 | 7.0 | O=C(O)c1cc(NC(=O)[C@@H](CCc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL342205 | 118364 | 0 | None | -35 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 765 | 12 | 5 | 5 | 7.0 | O=C(O)c1cc(NC(=O)[C@@H](CCc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10795162 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL2067970 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL342616 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
11561828 | 140096 | 0 | None | -4 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 468 | 7 | 3 | 2 | 6.8 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccccc3)[nH]c2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL381426 | 140096 | 0 | None | -4 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 468 | 7 | 3 | 2 | 6.8 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccccc3)[nH]c2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
44451547 | 96264 | 0 | None | -489 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 587 | 8 | 2 | 8 | 4.7 | CN(c1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCC3)C2=O)c1)c1nn[nH]n1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL264150 | 96264 | 0 | None | -489 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 587 | 8 | 2 | 8 | 4.7 | CN(c1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCC3)C2=O)c1)c1nn[nH]n1 | 10.1016/j.bmc.2007.12.047 | ||
16733469 | 85093 | 0 | None | -6309 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 576 | 10 | 2 | 6 | 5.8 | O=C(O)CSc1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1021/jm070139l | ||
CHEMBL227333 | 85093 | 0 | None | -6309 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 576 | 10 | 2 | 6 | 5.8 | O=C(O)CSc1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1021/jm070139l | ||
44296914 | 100779 | 0 | None | -1318 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 765 | 12 | 5 | 5 | 7.0 | O=C(CC1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL296167 | 100779 | 0 | None | -1318 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 765 | 12 | 5 | 5 | 7.0 | O=C(CC1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL3351052 | 209790 | 0 | None | -14 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)C1CCCCC1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
44357058 | 164306 | 0 | None | -173 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 785 | 11 | 5 | 5 | 7.3 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccccc2Cl)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL421921 | 164306 | 0 | None | -173 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 785 | 11 | 5 | 5 | 7.3 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccccc2Cl)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
10794888 | 164700 | 0 | None | -15 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1 | 10.1021/jm00021a019 | ||
CHEMBL422981 | 164700 | 0 | None | -15 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 707 | 10 | 4 | 4 | 6.9 | O=C(O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1 | 10.1021/jm00021a019 | ||
16732444 | 142774 | 0 | None | -2570 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3cnn(CC(=O)O)c3c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL389713 | 142774 | 0 | None | -2570 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3cnn(CC(=O)O)c3c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44346225 | 161360 | 0 | None | -12022 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 564 | 6 | 3 | 4 | 5.6 | O=C(Nc1cccc(CO)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL415240 | 161360 | 0 | None | -12022 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 564 | 6 | 3 | 4 | 5.6 | O=C(Nc1cccc(CO)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
9985629 | 167496 | 0 | None | -41 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 577 | 8 | 3 | 3 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Br)cc1 | 10.1021/jm00072a005 | ||
CHEMBL432389 | 167496 | 0 | None | -41 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 577 | 8 | 3 | 3 | 6.1 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Br)cc1 | 10.1021/jm00072a005 | ||
10768308 | 14726 | 0 | None | -19 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 520 | 4 | 2 | 3 | 5.7 | O=C(Nc1ccccc1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)C1=O | 10.1021/jm990967h | ||
CHEMBL120793 | 14726 | 0 | None | -19 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 520 | 4 | 2 | 3 | 5.7 | O=C(Nc1ccccc1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)C1=O | 10.1021/jm990967h | ||
10506830 | 113468 | 0 | None | -6 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 548 | 6 | 2 | 3 | 6.5 | O=C(Nc1ccccc1)NC1C(=O)N(CCC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL332601 | 113468 | 0 | None | -6 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 548 | 6 | 2 | 3 | 6.5 | O=C(Nc1ccccc1)NC1C(=O)N(CCC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
11664728 | 133898 | 0 | None | -10 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 482 | 7 | 3 | 2 | 7.1 | Cc1ccccc1-c1cc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL371750 | 133898 | 0 | None | -10 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 482 | 7 | 3 | 2 | 7.1 | Cc1ccccc1-c1cc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
10554602 | 15123 | 0 | None | -29 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 546 | 7 | 2 | 4 | 6.3 | CSc1cccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL121331 | 15123 | 0 | None | -29 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 546 | 7 | 2 | 4 | 6.3 | CSc1cccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
10505959 | 112992 | 0 | None | -74 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 513 | 6 | 2 | 4 | 5.4 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331975 | 112992 | 0 | None | -74 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 513 | 6 | 2 | 4 | 5.4 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
44345980 | 113635 | 0 | None | -79 | 2 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 538 | 6 | 2 | 7 | 6.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(C3N=NN=N3)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL332902 | 113635 | 0 | None | -79 | 2 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 538 | 6 | 2 | 7 | 6.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(C3N=NN=N3)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
44387568 | 61878 | 0 | None | -144 | 3 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 660 | 11 | 7 | 6 | 2.0 | C[C@@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm0000416 | ||
CHEMBL177799 | 61878 | 0 | None | -144 | 3 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 660 | 11 | 7 | 6 | 2.0 | C[C@@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm0000416 | ||
10327028 | 89025 | 0 | None | -144 | 3 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 660 | 11 | 7 | 6 | 2.0 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL2371222 | 89025 | 0 | None | -144 | 3 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 660 | 11 | 7 | 6 | 2.0 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
19700615 | 63823 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808417 | 63823 | 0 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
10652142 | 101099 | 0 | None | -1819 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 679 | 11 | 5 | 6 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccsc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL298521 | 101099 | 0 | None | -1819 | 2 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 679 | 11 | 5 | 6 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccsc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
138106885 | 166358 | 71 | None | -1 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
36314 | 166358 | 71 | None | -1 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
CHEMBL428647 | 166358 | 71 | None | -1 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | nan | ||
44331524 | 163114 | 0 | None | -13 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 530 | 8 | 2 | 3 | 6.5 | CC(CC1CCCC1)N1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(C(C)CC2CCCC2)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL420459 | 163114 | 0 | None | -13 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 530 | 8 | 2 | 3 | 6.5 | CC(CC1CCCC1)N1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(C(C)CC2CCCC2)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
10101023 | 89027 | 0 | None | -57 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 675 | 11 | 8 | 7 | -0.1 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CC(=O)NCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL2371224 | 89027 | 0 | None | -57 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 675 | 11 | 8 | 7 | -0.1 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CC(=O)NCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL3350720 | 209742 | 0 | None | -4 | 2 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00174a016 | ||||
11541870 | 71107 | 0 | None | -33 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 433 | 7 | 3 | 3 | 5.4 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL196141 | 71107 | 0 | None | -33 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 433 | 7 | 3 | 3 | 5.4 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
44451622 | 95470 | 0 | None | -371 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 562 | 9 | 2 | 5 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CCC(=O)O)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL259276 | 95470 | 0 | None | -371 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 562 | 9 | 2 | 5 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CCC(=O)O)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
44451920 | 95680 | 0 | None | -245 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 519 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL260394 | 95680 | 0 | None | -245 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 519 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
10325110 | 111495 | 0 | None | -29 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 544 | 9 | 3 | 5 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc([N+](=O)[O-])cc1 | 10.1021/jm00072a005 | ||
CHEMBL328852 | 111495 | 0 | None | -29 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 544 | 9 | 3 | 5 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc([N+](=O)[O-])cc1 | 10.1021/jm00072a005 | ||
10006936 | 205991 | 0 | None | -5 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 521 | 6 | 3 | 3 | 6.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)Nc1ccc2ccccc2c1 | 10.1021/jm00072a005 | ||
CHEMBL95689 | 205991 | 0 | None | -5 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 521 | 6 | 3 | 3 | 6.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)Nc1ccc2ccccc2c1 | 10.1021/jm00072a005 | ||
9985004 | 205884 | 0 | None | -26 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 549 | 8 | 3 | 3 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1cccc2ccccc12 | 10.1021/jm00072a005 | ||
CHEMBL95115 | 205884 | 0 | None | -26 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 549 | 8 | 3 | 3 | 6.5 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1cccc2ccccc12 | 10.1021/jm00072a005 | ||
44331506 | 106801 | 0 | None | -22 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 574 | 5 | 2 | 3 | 6.8 | O=C(Nc1cccc(Cl)c1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL317108 | 106801 | 0 | None | -22 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 574 | 5 | 2 | 3 | 6.8 | O=C(Nc1cccc(Cl)c1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
44346825 | 114275 | 0 | None | -77 | 2 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
CHEMBL333920 | 114275 | 0 | None | -77 | 2 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL3351050 | 209788 | 0 | None | -33 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12 | 10.1021/jm00053a022 | ||||
CHEMBL171594 | 207105 | 0 | None | -33 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
73347063 | 89024 | 0 | None | -162 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 674 | 11 | 7 | 6 | 2.4 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL2371221 | 89024 | 0 | None | -162 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 674 | 11 | 7 | 6 | 2.4 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
22171089 | 93549 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(OC)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248552 | 93549 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(OC)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
15002730 | 93590 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(C(Cc2cc(-c3ccc(Cl)cc3)n(-c3ccc(OC)cc3)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248752 | 93590 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(C(Cc2cc(-c3ccc(Cl)cc3)n(-c3ccc(OC)cc3)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
22171039 | 93591 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(C)cc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248754 | 93591 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(C)cc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
44444767 | 93624 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248948 | 93624 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
10343558 | 93625 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(Cl)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248949 | 93625 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(Cl)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
15002734 | 93626 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3OC)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL248950 | 93626 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3OC)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
10388627 | 93668 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(OC)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249151 | 93668 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(OC)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
10366068 | 93669 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(C(Cc2cc(-c3ccc(C)cc3)n(-c3ccc(OC)cc3)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249153 | 93669 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 442 | 8 | 1 | 5 | 5.3 | COc1ccc(C(Cc2cc(-c3ccc(C)cc3)n(-c3ccc(OC)cc3)n2)C(=O)O)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
22171037 | 93709 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(C)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249361 | 93709 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(C)c3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
10320262 | 93736 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(C)cc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249560 | 93736 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(C)cc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
44444777 | 93765 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL249763 | 93765 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 5.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
11754311 | 93887 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(Cl)cc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL250576 | 93887 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.3 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(Cl)cc3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
22171092 | 153962 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(C)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL399055 | 153962 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(C)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
10433726 | 153963 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(Cl)cc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL399056 | 153963 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 446 | 7 | 1 | 4 | 5.9 | COc1ccc(-n2nc(CC(C(=O)O)c3ccc(Cl)cc3)cc2-c2ccc(C)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
22171012 | 154196 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.3 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(Cl)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL399915 | 154196 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 7 | 1 | 4 | 6.3 | COc1ccc(-n2nc(CC(C(=O)O)c3cccc(Cl)c3)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
44444763 | 154330 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3OC)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
CHEMBL400670 | 154330 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.6 | COc1ccc(-n2nc(CC(C(=O)O)c3ccccc3OC)cc2-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2007.09.093 | ||
45486974 | 196013 | 0 | None | 50 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 580 | 7 | 3 | 7 | 4.8 | C[C@@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)[C@@H](O)c1cccc(Br)c1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL571206 | 196013 | 0 | None | 50 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 580 | 7 | 3 | 7 | 4.8 | C[C@@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)[C@@H](O)c1cccc(Br)c1 | 10.1016/j.bmcl.2009.09.064 | ||
44271963 | 96277 | 0 | None | -4466 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)[C@H](NC(=O)OC(C)(C)C)CCC(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL264273 | 96277 | 0 | None | -4466 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)[C@H](NC(=O)OC(C)(C)C)CCC(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
11555184 | 165479 | 0 | None | -281 | 3 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 503 | 7 | 3 | 3 | 7.0 | Cc1ccc(NC(=O)c2[nH]c(C3(C)CCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm0490686 | ||
CHEMBL425574 | 165479 | 0 | None | -281 | 3 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 503 | 7 | 3 | 3 | 7.0 | Cc1ccc(NC(=O)c2[nH]c(C3(C)CCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm0490686 | ||
45255234 | 197358 | 0 | None | -15 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 584 | 8 | 3 | 7 | 4.9 | O=C(N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL585914 | 197358 | 0 | None | -15 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 584 | 8 | 3 | 7 | 4.9 | O=C(N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486935 | 195084 | 0 | None | -25 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 612 | 8 | 3 | 7 | 4.5 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL565298 | 195084 | 0 | None | -25 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 612 | 8 | 3 | 7 | 4.5 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
45486976 | 197294 | 0 | None | -39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 656 | 8 | 3 | 7 | 4.6 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL585157 | 197294 | 0 | None | -39 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 656 | 8 | 3 | 7 | 4.6 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.065 | ||
10792724 | 14295 | 0 | None | -162 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 548 | 5 | 2 | 3 | 6.4 | Cc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL120031 | 14295 | 0 | None | -162 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 548 | 5 | 2 | 3 | 6.4 | Cc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
10793611 | 15325 | 0 | None | -4 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 7 | 2 | 4 | 7.2 | CSc1cccc(NC(=O)NC2C(=O)N(CCC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL121624 | 15325 | 0 | None | -4 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 7 | 2 | 4 | 7.2 | CSc1cccc(NC(=O)NC2C(=O)N(CCC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
19043400 | 98288 | 0 | None | -162 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 480 | 4 | 2 | 3 | 5.1 | O=C(Nc1ccccc1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2CC3CCC2C3)C1=O | 10.1021/jm990967h | ||
CHEMBL278018 | 98288 | 0 | None | -162 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 480 | 4 | 2 | 3 | 5.1 | O=C(Nc1ccccc1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2CC3CCC2C3)C1=O | 10.1021/jm990967h | ||
9869202 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
CHEMBL197716 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
CHEMBL2067960 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
44444930 | 154383 | 0 | None | - | 1 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 688 | 11 | 6 | 6 | 5.7 | Nc1cccc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)c(C(=O)NCC34CC5CC(CC(C5)C3)C4)cc12 | 10.1021/jm070880t | ||
CHEMBL400974 | 154383 | 0 | None | - | 1 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 688 | 11 | 6 | 6 | 5.7 | Nc1cccc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)c(C(=O)NCC34CC5CC(CC(C5)C3)C4)cc12 | 10.1021/jm070880t | ||
44444931 | 154406 | 0 | None | - | 1 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 688 | 11 | 6 | 6 | 5.7 | Nc1cccc2cc(C(=O)NCC34CC5CC(CC(C5)C3)C4)c(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)cc12 | 10.1021/jm070880t | ||
CHEMBL401097 | 154406 | 0 | None | - | 1 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 688 | 11 | 6 | 6 | 5.7 | Nc1cccc2cc(C(=O)NCC34CC5CC(CC(C5)C3)C4)c(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)cc12 | 10.1021/jm070880t | ||
16090789 | 82837 | 0 | None | 3 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 521 | 6 | 2 | 7 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCCC2)c(NS(=O)(=O)c2cccc3nsnc23)c1)c1ccccc1 | 10.1021/jm060590x | ||
CHEMBL218729 | 82837 | 0 | None | 3 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 521 | 6 | 2 | 7 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCCC2)c(NS(=O)(=O)c2cccc3nsnc23)c1)c1ccccc1 | 10.1021/jm060590x | ||
16733466 | 85092 | 0 | None | -7413 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 10 | 2 | 5 | 5.6 | O=C(O)CCc1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1021/jm070139l | ||
CHEMBL227330 | 85092 | 0 | None | -7413 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 558 | 10 | 2 | 5 | 5.6 | O=C(O)CCc1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1 | 10.1021/jm070139l | ||
16732165 | 168382 | 0 | None | -3235 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 571 | 8 | 2 | 6 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3c(ccn3CC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL438843 | 168382 | 0 | None | -3235 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 571 | 8 | 2 | 6 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3c(ccn3CC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
9936141 | 12156 | 0 | None | -12 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 510 | 7 | 4 | 3 | 7.0 | O=C(O)c1cc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184700 | 12156 | 0 | None | -12 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 510 | 7 | 4 | 3 | 7.0 | O=C(O)c1cc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067956 | 12156 | 0 | None | -12 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 510 | 7 | 4 | 3 | 7.0 | O=C(O)c1cc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
9869202 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
CHEMBL197716 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
CHEMBL2067960 | 71732 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 467 | 6 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
44444932 | 154312 | 0 | None | - | 1 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.8 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)C(=O)O | 10.1021/jm070880t | ||
CHEMBL400548 | 154312 | 0 | None | - | 1 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.8 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2)C(=O)O | 10.1021/jm070880t | ||
44357208 | 118478 | 0 | None | -4 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 737 | 10 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)c2ccccc2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL342465 | 118478 | 0 | None | -4 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 737 | 10 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)c2ccccc2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
56673524 | 63824 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808418 | 63824 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
10842269 | 101103 | 0 | None | -575 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 681 | 11 | 6 | 6 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL298551 | 101103 | 0 | None | -575 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 681 | 11 | 6 | 6 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
10698746 | 116285 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 4.0 | O=C(O)CNC(=O)[C@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3 | 10.1021/jm00021a019 | ||
CHEMBL337743 | 116285 | 0 | None | -3 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 4.0 | O=C(O)CNC(=O)[C@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3 | 10.1021/jm00021a019 | ||
19700615 | 63823 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808417 | 63823 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
11799257 | 112968 | 0 | None | -32 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCc2ccccc2)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL331929 | 112968 | 0 | None | -32 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.1 | O=C(Nc1ccccc1)NC1C(=O)N(CCc2ccccc2)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
10795162 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL2067970 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL342616 | 118533 | 0 | None | -630 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 751 | 11 | 5 | 5 | 6.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
19700643 | 63688 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1807152 | 63688 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
10439779 | 106204 | 0 | None | -5 | 3 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 710 | 11 | 7 | 8 | 2.2 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCSSCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL3143501 | 106204 | 0 | None | -5 | 3 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 710 | 11 | 7 | 8 | 2.2 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCSSCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
56663144 | 63808 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 507 | 8 | 2 | 5 | 3.2 | Cc1cccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)c1 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808400 | 63808 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 507 | 8 | 2 | 5 | 3.2 | Cc1cccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)c1 | 10.1016/j.bmc.2011.05.057 | ||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
887 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070139l | ||
9870520 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070139l | ||
CHEMBL324547 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070139l | ||
DB12355 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070139l | ||
44451581 | 95381 | 0 | None | -316 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 9 | 2 | 6 | 6.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCC(=O)O)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL258863 | 95381 | 0 | None | -316 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 594 | 9 | 2 | 6 | 6.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCC(=O)O)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
10652140 | 101374 | 0 | None | -177 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 679 | 11 | 7 | 7 | 4.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL300456 | 101374 | 0 | None | -177 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 679 | 11 | 7 | 7 | 4.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
44329398 | 205954 | 0 | None | -12 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 543 | 10 | 3 | 4 | 4.8 | O=C(O)CN(CCc1ccccc1)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00072a005 | ||
CHEMBL95461 | 205954 | 0 | None | -12 | 2 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 543 | 10 | 3 | 4 | 4.8 | O=C(O)CN(CCc1ccccc1)C(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 | 10.1021/jm00072a005 | ||
10098459 | 4201 | 0 | None | -208 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 528 | 7 | 2 | 3 | 5.8 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL100548 | 4201 | 0 | None | -208 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 528 | 7 | 2 | 3 | 5.8 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
73354642 | 89028 | 0 | None | -46 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 646 | 11 | 7 | 6 | 1.6 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
CHEMBL2371225 | 89028 | 0 | None | -46 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 646 | 11 | 7 | 6 | 1.6 | C[C@]1(Cc2c[nH]c3ccccc23)NC(=O)CCCCCC[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)NC1=O | 10.1021/jm9603072 | ||
11568611 | 71635 | 0 | None | -263 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 449 | 6 | 3 | 3 | 5.8 | CC(C)(C)c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL197370 | 71635 | 0 | None | -263 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 449 | 6 | 3 | 3 | 5.8 | CC(C)(C)c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
5311188 | 9712 | 2 | None | -1 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
CHEMBL113718 | 9712 | 2 | None | -1 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
44265912 | 204681 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 354 | 6 | 2 | 1 | 5.1 | O=C(NCCC(c1ccccc1)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
CHEMBL8779 | 204681 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 354 | 6 | 2 | 1 | 5.1 | O=C(NCCC(c1ccccc1)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
44346355 | 157325 | 0 | None | -446 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1260 | 26 | 13 | 15 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0000416 | ||
CHEMBL408389 | 157325 | 0 | None | -446 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1260 | 26 | 13 | 15 | 1.7 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0000416 | ||
CHEMBL2370588 | 208127 | 0 | None | -446 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||||
CHEMBL3350335 | 209728 | 0 | None | -245 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
CHEMBL3142843 | 209390 | 0 | None | -6 | 2 | Guinea pig | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/jm00174a016 | ||||
11495719 | 70030 | 0 | None | -14 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 431 | 7 | 3 | 3 | 5.8 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC2CCCCC2)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL194514 | 70030 | 0 | None | -14 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 431 | 7 | 3 | 3 | 5.8 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC2CCCCC2)[nH]1 | 10.1021/jm0490686 | ||
10817243 | 113018 | 0 | None | -22 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 591 | 7 | 2 | 4 | 6.6 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL332128 | 113018 | 0 | None | -22 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 591 | 7 | 2 | 4 | 6.6 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
16733051 | 136433 | 0 | None | -758 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 595 | 8 | 2 | 7 | 4.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)NS(C)(=O)=O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL374390 | 136433 | 0 | None | -758 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 595 | 8 | 2 | 7 | 4.2 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)NS(C)(=O)=O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
11800981 | 10114 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
CHEMBL116001 | 10114 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12 | 10.1021/jm9703247 | ||
44379428 | 57866 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 557 | 9 | 3 | 6 | 4.9 | C[C@@](N)(Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80669-1 | ||
CHEMBL168182 | 57866 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 557 | 9 | 3 | 6 | 4.9 | C[C@@](N)(Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)N[C@H](CC(=O)O)Cc1ccccc1 | 10.1016/S0960-894X(00)80669-1 | ||
CHEMBL1206136 | 206862 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
CHEMBL218455 | 206862 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
10372489 | 4198 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 692 | 20 | 7 | 7 | 1.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)O | 10.1021/jm0000416 | ||
CHEMBL100538 | 4198 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 692 | 20 | 7 | 7 | 1.3 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)O | 10.1021/jm0000416 | ||
44359425 | 14575 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL1206331 | 14575 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
CHEMBL262687 | 14575 | 0 | None | - | 1 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1031 | 30 | 11 | 11 | 1.0 | CCCC[C@H](NC(=O)[C@H](Cc1ccc(CS(=O)(=O)O)cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||
90662935 | 106093 | 0 | None | 10 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1057 | 30 | 11 | 11 | 2.6 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL3142373 | 106093 | 0 | None | 10 | 2 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 1057 | 30 | 11 | 11 | 2.6 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)/C=C/c1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10075052 | 189082 | 0 | None | 10 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL515268 | 189082 | 0 | None | 10 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
CHEMBL515288 | 189082 | 0 | None | 10 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 510 | 3 | 2 | 3 | 4.3 | CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm801439x | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
44215880 | 69065 | 0 | None | 3890 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933100 | 69065 | 0 | None | 3890 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)NC(CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
887 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm051219x | ||
9870520 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm051219x | ||
CHEMBL324547 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm051219x | ||
DB12355 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm051219x | ||
10460632 | 206589 | 0 | None | -43 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1ccc2ccccc2c1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99252 | 206589 | 0 | None | -43 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1ccc2ccccc2c1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
9890720 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
CHEMBL2067971 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
CHEMBL435127 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm0490686 | ||
44356448 | 167676 | 0 | None | -75 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2cccc(F)c2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL433656 | 167676 | 0 | None | -75 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2cccc(F)c2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
44356666 | 168064 | 0 | None | -16 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 799 | 11 | 3 | 11 | 5.2 | O=C(NCC12CC3CC(CC(C3)C1)C2)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-n2cnnn2)cc(-n2cnnn2)c1 | 10.1021/jm00021a019 | ||
CHEMBL436187 | 168064 | 0 | None | -16 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 799 | 11 | 3 | 11 | 5.2 | O=C(NCC12CC3CC(CC(C3)C1)C2)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-n2cnnn2)cc(-n2cnnn2)c1 | 10.1021/jm00021a019 | ||
11643045 | 71794 | 0 | None | -43 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 511 | 9 | 3 | 3 | 6.8 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(CCC(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL197873 | 71794 | 0 | None | -43 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 511 | 9 | 3 | 3 | 6.8 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(CCC(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
10793342 | 112606 | 0 | None | -158 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 579 | 6 | 2 | 5 | 6.0 | O=C(Nc1cccc([N+](=O)[O-])c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL331405 | 112606 | 0 | None | -158 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 579 | 6 | 2 | 5 | 6.0 | O=C(Nc1cccc([N+](=O)[O-])c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44329798 | 107063 | 0 | None | -245 | 5 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 610 | 10 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(C(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL318852 | 107063 | 0 | None | -245 | 5 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 610 | 10 | 2 | 4 | 6.5 | CC(Cc1c[nH]c2ccccc12)(C(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O | 10.1021/jm00072a005 | ||
19700615 | 63823 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808417 | 63823 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 589 | 7 | 2 | 5 | 4.2 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2cc(F)ccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
887 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1016/j.bmc.2007.12.047 | ||
9870520 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL324547 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1016/j.bmc.2007.12.047 | ||
DB12355 | 4047 | 24 | None | -380 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1016/j.bmc.2007.12.047 | ||
11534594 | 197122 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 616 | 8 | 2 | 6 | 7.0 | O=C(NCC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL583343 | 197122 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 616 | 8 | 2 | 6 | 7.0 | O=C(NCC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
10071178 | 74146 | 1 | None | 501 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
CHEMBL202861 | 74146 | 1 | None | 501 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
CHEMBL3350665 | 209736 | 0 | None | -3 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
44272041 | 96636 | 0 | None | -338 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL267329 | 96636 | 0 | None | -338 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
10459641 | 111746 | 0 | None | -26 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 529 | 9 | 3 | 4 | 5.4 | COc1ccc(CCNC(=O)C(C)(Cc2c[nH]c3ccccc23)NC(=O)OC2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)cc1 | 10.1021/jm00072a005 | ||
CHEMBL329088 | 111746 | 0 | None | -26 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 529 | 9 | 3 | 4 | 5.4 | COc1ccc(CCNC(=O)C(C)(Cc2c[nH]c3ccccc23)NC(=O)OC2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)cc1 | 10.1021/jm00072a005 | ||
45486968 | 195793 | 0 | None | 1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 550 | 8 | 3 | 7 | 4.2 | O=C(N[C@H](Cc1ccc(Cl)cc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL569848 | 195793 | 0 | None | 1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 550 | 8 | 3 | 7 | 4.2 | O=C(N[C@H](Cc1ccc(Cl)cc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486985 | 196076 | 0 | None | -63 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 650 | 8 | 3 | 6 | 4.5 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL571650 | 196076 | 0 | None | -63 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 650 | 8 | 3 | 6 | 4.5 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
10411553 | 153361 | 0 | None | - | 1 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(-c3nnn[nH]3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm070880t | ||
CHEMBL398312 | 153361 | 0 | None | - | 1 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 452 | 4 | 3 | 6 | 2.8 | CN1C(=O)[C@H](NC(=O)Nc2cccc(-c3nnn[nH]3)c2)N=C(c2ccccc2)c2ccccc21 | 10.1021/jm070880t | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm070880t | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm070880t | ||
136036823 | 155137 | 0 | None | -263 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 574 | 7 | 2 | 7 | 4.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL404967 | 155137 | 0 | None | -263 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 574 | 7 | 2 | 7 | 4.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
10099495 | 107247 | 0 | None | -117 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 567 | 8 | 3 | 3 | 6.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)cc1Cl | 10.1021/jm00072a005 | ||
CHEMBL319120 | 107247 | 0 | None | -117 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 567 | 8 | 3 | 3 | 6.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCc1ccc(Cl)cc1Cl | 10.1021/jm00072a005 | ||
45486958 | 195911 | 0 | None | -19 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 516 | 8 | 3 | 7 | 3.6 | O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL570518 | 195911 | 0 | None | -19 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 516 | 8 | 3 | 7 | 3.6 | O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
44444928 | 154079 | 0 | None | - | 1 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 610 | 10 | 6 | 5 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL399252 | 154079 | 0 | None | - | 1 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 610 | 10 | 6 | 5 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
16090699 | 141384 | 0 | None | 1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 463 | 8 | 4 | 4 | 3.4 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccccc1NS(=O)(=O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
CHEMBL386985 | 141384 | 0 | None | 1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 463 | 8 | 4 | 4 | 3.4 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccccc1NS(=O)(=O)c1cc2ccccc2[nH]1 | 10.1021/jm060590x | ||
10603971 | 101144 | 0 | None | -208 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 624 | 11 | 6 | 5 | 5.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL298861 | 101144 | 0 | None | -208 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 624 | 11 | 6 | 5 | 5.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
9958028 | 11699 | 0 | None | -12 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 511 | 7 | 4 | 4 | 6.4 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1181937 | 11699 | 0 | None | -12 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 511 | 7 | 4 | 4 | 6.4 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067950 | 11699 | 0 | None | -12 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 511 | 7 | 4 | 4 | 6.4 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4ccccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
9956948 | 11823 | 0 | None | 1 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 483 | 7 | 4 | 4 | 6.0 | O=C(Nc1cc(CO)cc(CO)c1)c1[nH]c(-c2ccc3ccccc3c2)nc1CC1CCCCCC1 | 10.1021/jm049069y | ||
CHEMBL1182723 | 11823 | 0 | None | 1 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 483 | 7 | 4 | 4 | 6.0 | O=C(Nc1cc(CO)cc(CO)c1)c1[nH]c(-c2ccc3ccccc3c2)nc1CC1CCCCCC1 | 10.1021/jm049069y | ||
CHEMBL2067953 | 11823 | 0 | None | 1 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 483 | 7 | 4 | 4 | 6.0 | O=C(Nc1cc(CO)cc(CO)c1)c1[nH]c(-c2ccc3ccccc3c2)nc1CC1CCCCCC1 | 10.1021/jm049069y | ||
11576933 | 12162 | 0 | None | -19 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 499 | 7 | 4 | 4 | 5.5 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184725 | 12162 | 0 | None | -19 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 499 | 7 | 4 | 4 | 5.5 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067957 | 12162 | 0 | None | -19 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 499 | 7 | 4 | 4 | 5.5 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
44404005 | 12179 | 0 | None | -100 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 623 | 11 | 5 | 5 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184845 | 12179 | 0 | None | -100 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 623 | 11 | 5 | 5 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067963 | 12179 | 0 | None | -100 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 623 | 11 | 5 | 5 | 5.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL206974 | 207438 | 0 | None | -72 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm0303103 | ||||
CHEMBL1172249 | 206840 | 0 | None | -5 | 4 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
CHEMBL206974 | 207438 | 0 | None | -72 | 5 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
CHEMBL3351048 | 209786 | 0 | None | -5 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
CHEMBL407057 | 210888 | 0 | None | -1513 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O | 10.1021/jm050921q | ||||
11513177 | 72184 | 0 | None | -131 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 501 | 7 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(C34CCC(CC3)CC4)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL199091 | 72184 | 0 | None | -131 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 501 | 7 | 3 | 3 | 6.7 | O=C(O)c1cccc(NC(=O)c2[nH]c(C34CCC(CC3)CC4)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
10004216 | 4675 | 0 | None | -11 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL103750 | 4675 | 0 | None | -11 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
18472063 | 63826 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 529 | 7 | 2 | 4 | 4.3 | CN(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808420 | 63826 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 529 | 7 | 2 | 4 | 4.3 | CN(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1206136 | 206862 | 0 | None | - | 1 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
CHEMBL218455 | 206862 | 0 | None | - | 1 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00122a026 | ||||
54554106 | 63817 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN(C)C)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808411 | 63817 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN(C)C)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
10723216 | 161446 | 0 | None | -4466 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 680 | 11 | 6 | 5 | 5.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL415936 | 161446 | 0 | None | -4466 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 680 | 11 | 6 | 5 | 5.6 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL265595 | 208910 | 0 | None | -1584 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O | 10.1021/jm0303103 | ||||
10604664 | 154696 | 0 | None | -602 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 691 | 9 | 2 | 7 | 5.6 | O=C(Nc1cccc(C(=O)OCCN2CCOCC2)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL402702 | 154696 | 0 | None | -602 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 691 | 9 | 2 | 7 | 5.6 | O=C(Nc1cccc(C(=O)OCCN2CCOCC2)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
10580234 | 98577 | 0 | None | -251 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]ccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL280248 | 98577 | 0 | None | -251 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]ccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL3350331 | 209727 | 0 | None | 1 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
CHEMBL3350665 | 209736 | 0 | None | -3 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
44265916 | 205861 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 5 | 2 | 1 | 5.0 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
CHEMBL9500 | 205861 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 5 | 2 | 1 | 5.0 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1cc2ccccc2[nH]1 | 10.1021/jm00084a009 | ||
CHEMBL2371662 | 208361 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00389a002 | ||||
10031454 | 108101 | 0 | None | -67 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 596 | 10 | 2 | 4 | 5.5 | CC(Cc1ccc(Br)cc1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL320399 | 108101 | 0 | None | -67 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 596 | 10 | 2 | 4 | 5.5 | CC(Cc1ccc(Br)cc1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
56659684 | 63820 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 7 | 2 | 5 | 3.5 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC2CCCCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808414 | 63820 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 519 | 7 | 2 | 5 | 3.5 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC2CCCCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
10508004 | 11694 | 0 | None | -2454 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(Br)cc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL118189 | 11694 | 0 | None | -2454 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 612 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(Br)cc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44382456 | 119955 | 0 | None | -3162 | 3 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 572 | 10 | 5 | 5 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)cc1 | 10.1016/S0960-894X(00)80686-1 | ||
CHEMBL354049 | 119955 | 0 | None | -3162 | 3 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 572 | 10 | 5 | 5 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)cc1 | 10.1016/S0960-894X(00)80686-1 | ||
CHEMBL83942 | 119955 | 0 | None | -3162 | 3 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 572 | 10 | 5 | 5 | 4.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)cc1 | 10.1016/S0960-894X(00)80686-1 | ||
CHEMBL3351061 | 209796 | 0 | None | -4 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
9867157 | 99778 | 4 | None | 194 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 426 | 9 | 3 | 4 | 2.3 | O=C(O)C[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80008-6 | ||
CHEMBL288641 | 99778 | 4 | None | 194 | 2 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 426 | 9 | 3 | 4 | 2.3 | O=C(O)C[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NCCc1ccccc1 | 10.1016/S0960-894X(00)80008-6 | ||
44356825 | 168068 | 0 | None | -1621 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 767 | 11 | 6 | 6 | 6.3 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL436209 | 168068 | 0 | None | -1621 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 767 | 11 | 6 | 6 | 6.3 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
11798204 | 192995 | 0 | None | -10 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 460 | 5 | 2 | 3 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2ccccc2cc1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm9508907 | ||
CHEMBL53129 | 192995 | 0 | None | -10 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 460 | 5 | 2 | 3 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2ccccc2cc1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm9508907 | ||
10815832 | 15013 | 0 | None | -109 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 520 | 7 | 2 | 4 | 5.8 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL121021 | 15013 | 0 | None | -109 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 520 | 7 | 2 | 4 | 5.8 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL218763 | 207654 | 0 | None | -3630 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
CHEMBL120632 | 206863 | 30 | None | -2187 | 3 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0000416 | ||||
CHEMBL120632 | 206863 | 30 | None | -2187 | 3 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm9603072 | ||||
9939572 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL14557 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL2067949 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
16731711 | 85094 | 0 | None | -15 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 5.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL227369 | 85094 | 0 | None | -15 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 5.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1021/jm070139l | ||
10676212 | 115509 | 0 | None | -489 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 701 | 8 | 4 | 5 | 5.9 | O=C(O)c1cc(NC(=O)[C@H]2CCCN2C(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL335587 | 115509 | 0 | None | -489 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 701 | 8 | 4 | 5 | 5.9 | O=C(O)c1cc(NC(=O)[C@H]2CCCN2C(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
44280162 | 98997 | 0 | None | -21 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 667 | 8 | 3 | 5 | 6.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2Cl)C[C@@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
CHEMBL283040 | 98997 | 0 | None | -21 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 667 | 8 | 3 | 5 | 6.9 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1CC[C@H](Oc2ccc(Cl)cc2Cl)C[C@@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
10324322 | 107219 | 0 | None | -43 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 518 | 10 | 2 | 4 | 4.7 | CC(Cc1ccccc1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL319085 | 107219 | 0 | None | -43 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 518 | 10 | 2 | 4 | 4.7 | CC(Cc1ccccc1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
10484529 | 100963 | 0 | None | -707 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 663 | 11 | 5 | 6 | 5.8 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccoc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL297480 | 100963 | 0 | None | -707 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 663 | 11 | 5 | 6 | 5.8 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccoc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
44272042 | 96599 | 0 | None | -131 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
CHEMBL266990 | 96599 | 0 | None | -131 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 1274 | 26 | 13 | 15 | 2.1 | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](Cc2ccc(OS(=O)(=O)O)cc2)C(=O)N[C@@H](CCCC)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00126a007 | ||
16732021 | 167911 | 0 | None | -549 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 588 | 9 | 2 | 8 | 5.3 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL435143 | 167911 | 0 | None | -549 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 588 | 9 | 2 | 8 | 5.3 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCc3nn[nH]n3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44451843 | 158892 | 0 | None | -1230 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CC(=O)O)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL410114 | 158892 | 0 | None | -1230 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 562 | 8 | 2 | 5 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CC(=O)O)c2)C(=O)N(C2CCCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL132314 | 206960 | 0 | None | -6456 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0303103 | ||||
44461961 | 105130 | 0 | None | -446 | 3 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 724 | 11 | 4 | 5 | 6.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N=[N+]=[N-])c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
CHEMBL2079605 | 105130 | 0 | None | -446 | 3 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 724 | 11 | 4 | 5 | 6.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N=[N+]=[N-])c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
CHEMBL312252 | 105130 | 0 | None | -446 | 3 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 724 | 11 | 4 | 5 | 6.8 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N=[N+]=[N-])c(I)c1 | 10.1016/0960-894X(95)00435-V | ||
11547802 | 135480 | 0 | None | -177 | 2 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 497 | 8 | 3 | 3 | 6.4 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(CC(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL373168 | 135480 | 0 | None | -177 | 2 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 497 | 8 | 3 | 3 | 6.4 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(CC(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
45486941 | 195089 | 0 | None | 1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 516 | 7 | 2 | 6 | 4.2 | O=C(NCCc1ccccc1)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL565325 | 195089 | 0 | None | 1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 516 | 7 | 2 | 6 | 4.2 | O=C(NCCc1ccccc1)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486964 | 195718 | 0 | None | -39 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 606 | 8 | 3 | 6 | 4.4 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
CHEMBL569391 | 195718 | 0 | None | -39 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 606 | 8 | 3 | 6 | 4.4 | O=C(N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nccnc12 | 10.1016/j.bmcl.2009.09.065 | ||
887 | 4047 | 24 | None | -5011 | 4 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070880t | ||
9870520 | 4047 | 24 | None | -5011 | 4 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070880t | ||
CHEMBL324547 | 4047 | 24 | None | -5011 | 4 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070880t | ||
DB12355 | 4047 | 24 | None | -5011 | 4 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 498 | 6 | 3 | 6 | 4.1 | CNc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccn2)c2c(N(C1=O)CC(=O)C(C)(C)C)cccc2 | 10.1021/jm070880t | ||
45486949 | 195270 | 0 | None | -50 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 516 | 8 | 3 | 7 | 3.6 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL566390 | 195270 | 0 | None | -50 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 516 | 8 | 3 | 7 | 3.6 | O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
45486970 | 195952 | 0 | None | -3 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 578 | 8 | 3 | 7 | 5.0 | CC(C)(c1ccc(Cl)cc1)[C@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL570761 | 195952 | 0 | None | -3 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 578 | 8 | 3 | 7 | 5.0 | CC(C)(c1ccc(Cl)cc1)[C@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
45486997 | 196106 | 0 | None | -12 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 486 | 7 | 1 | 6 | 4.5 | CN(CCc1ccccc1)C(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL571832 | 196106 | 0 | None | -12 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 486 | 7 | 1 | 6 | 4.5 | CN(CCc1ccccc1)C(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
9939572 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL14557 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL2067949 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
10327180 | 37401 | 0 | None | - | 1 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 676 | 11 | 5 | 6 | 5.5 | Cn1ccc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)c(C(=O)NCC34CC5CC(CC(C5)C3)C4)cc21 | 10.1021/jm070880t | ||
CHEMBL14571 | 37401 | 0 | None | - | 1 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 676 | 11 | 5 | 6 | 5.5 | Cn1ccc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)c(C(=O)NCC34CC5CC(CC(C5)C3)C4)cc21 | 10.1021/jm070880t | ||
44425006 | 141548 | 0 | None | -3311 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 544 | 8 | 2 | 5 | 5.6 | CC1CCCC1C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL388068 | 141548 | 0 | None | -3311 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 544 | 8 | 2 | 5 | 5.6 | CC1CCCC1C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44404001 | 11828 | 0 | None | -6 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 635 | 11 | 6 | 6 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(CO)cc(CO)c1 | 10.1021/jm049069y | ||
CHEMBL1182744 | 11828 | 0 | None | -6 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 635 | 11 | 6 | 6 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(CO)cc(CO)c1 | 10.1021/jm049069y | ||
CHEMBL2067969 | 11828 | 0 | None | -6 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 635 | 11 | 6 | 6 | 4.5 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(CO)cc(CO)c1 | 10.1021/jm049069y | ||
44403982 | 12172 | 0 | None | -7 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 4.9 | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)c1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184798 | 12172 | 0 | None | -7 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 4.9 | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)c1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067958 | 12172 | 0 | None | -7 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 677 | 11 | 5 | 6 | 4.9 | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2[nH]cnc2cc1C(=O)NCC12CC3CC(CC(C3)C1)C2)c1cc(C(=O)O)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
9939572 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL14557 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067949 | 37258 | 0 | None | -3548 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 662 | 11 | 6 | 5 | 5.5 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3cc[nH]c3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
9890720 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
CHEMBL2067971 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
CHEMBL435127 | 167905 | 0 | None | -2 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 466 | 6 | 3 | 2 | 7.3 | O=C(O)c1cccc(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]c2CC2CCCCCC2)c1 | 10.1021/jm049069y | ||
10509945 | 88954 | 0 | None | 229 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL2369816 | 88954 | 0 | None | 229 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N(C)[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL384035 | 210569 | 1 | None | -22 | 4 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00389a002 | ||||
CHEMBL428666 | 210569 | 1 | None | -22 | 4 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00389a002 | ||||
10508430 | 16163 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 648 | 18 | 6 | 6 | 1.8 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC | 10.1021/jm0000416 | ||
CHEMBL122872 | 16163 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 648 | 18 | 6 | 6 | 1.8 | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC | 10.1021/jm0000416 | ||
44332766 | 107850 | 0 | None | 48 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(F)ccc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL319795 | 107850 | 0 | None | 48 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(F)ccc21 | 10.1016/0960-894X(95)00528-2 | ||
19043395 | 4705 | 0 | None | 194 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(Cl)ccc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL103968 | 4705 | 0 | None | 194 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(Cl)ccc21 | 10.1016/0960-894X(95)00528-2 | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
44265985 | 205939 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 376 | 6 | 2 | 1 | 6.0 | O=C(NCCC=C(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
CHEMBL9538 | 205939 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 376 | 6 | 2 | 1 | 6.0 | O=C(NCCC=C(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
44265913 | 204867 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 381 | 5 | 1 | 1 | 5.9 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00084a009 | ||
CHEMBL8893 | 204867 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 381 | 5 | 1 | 1 | 5.9 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00084a009 | ||
10604230 | 114713 | 0 | None | -5 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 4.8 | O=C(O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
CHEMBL334523 | 114713 | 0 | None | -5 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 645 | 10 | 4 | 4 | 4.8 | O=C(O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
10676196 | 118735 | 0 | None | -234 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 699 | 11 | 5 | 5 | 6.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC2CCCCC2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL343515 | 118735 | 0 | None | -234 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 699 | 11 | 5 | 5 | 6.0 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC2CCCCC2)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
56673523 | 63819 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 479 | 10 | 2 | 4 | 3.9 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808413 | 63819 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 479 | 10 | 2 | 4 | 3.9 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
16732018 | 85043 | 0 | None | -741 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 548 | 9 | 2 | 6 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(OCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL226729 | 85043 | 0 | None | -741 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 548 | 9 | 2 | 6 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(OCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
10769001 | 112682 | 0 | None | -13803 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 549 | 5 | 3 | 4 | 5.7 | Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331468 | 112682 | 0 | None | -13803 | 2 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 549 | 5 | 3 | 4 | 5.7 | Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
10390666 | 206564 | 0 | None | -17 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 485 | 7 | 3 | 3 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL99076 | 206564 | 0 | None | -17 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 485 | 7 | 3 | 3 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCc1ccccc1 | 10.1021/jm00072a005 | ||
19043358 | 4295 | 0 | None | 22 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccc(Cl)cc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL101125 | 4295 | 0 | None | 22 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 5.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccc(Cl)cc21 | 10.1016/0960-894X(95)00528-2 | ||
44408524 | 155164 | 0 | None | -169 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL405192 | 155164 | 0 | None | -169 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 1134 | 30 | 12 | 15 | 2.6 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
11605694 | 168088 | 0 | None | -70 | 3 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 497 | 7 | 3 | 3 | 6.8 | Cc1ccc(NC(=O)c2[nH]c(-c3ccccc3C)nc2CCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm0490686 | ||
CHEMBL436314 | 168088 | 0 | None | -70 | 3 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 497 | 7 | 3 | 3 | 6.8 | Cc1ccc(NC(=O)c2[nH]c(-c3ccccc3C)nc2CCC23CC4CC(CC(C4)C2)C3)cc1C(=O)O | 10.1021/jm0490686 | ||
10818497 | 25648 | 0 | None | -58 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 701 | 8 | 4 | 5 | 5.9 | O=C(O)c1cc(NC(=O)[C@@H]2CCCN2C(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL135344 | 25648 | 0 | None | -58 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 701 | 8 | 4 | 5 | 5.9 | O=C(O)c1cc(NC(=O)[C@@H]2CCCN2C(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL3351054 | 209792 | 0 | None | -812 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc2ccccc2c1)C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
9983949 | 206007 | 0 | None | -23 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 513 | 9 | 3 | 3 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL95793 | 206007 | 0 | None | -23 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 513 | 9 | 3 | 3 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)NCCCc1ccccc1 | 10.1021/jm00072a005 | ||
52949124 | 863 | 2 | None | -2 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
9055 | 863 | 2 | None | -2 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL1269258 | 863 | 2 | None | -2 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
DB12694 | 863 | 2 | None | -2 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 594 | 8 | 1 | 5 | 6.5 | CC(N(C(=O)CN1c2ccccc2n2c([C@@H](C1=O)Cc1c[nH]c3c1cccc3)nnc2c1ccccc1)Cc1ccccc1)C | 10.1021/acs.jmedchem.5b01110 | ||
10531553 | 116130 | 0 | None | -31 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 4.0 | O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3 | 10.1021/jm00021a019 | ||
CHEMBL336896 | 116130 | 0 | None | -31 | 2 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 595 | 7 | 3 | 4 | 4.0 | O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3 | 10.1021/jm00021a019 | ||
44346345 | 112585 | 0 | None | -43 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 523 | 5 | 2 | 4 | 5.1 | CN(C)c1cccc(NC(=O)NC2C(=O)N(c3ccccc3)c3ccccc3N(C3CC4CCC3C4)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331262 | 112585 | 0 | None | -43 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 523 | 5 | 2 | 4 | 5.1 | CN(C)c1cccc(NC(=O)NC2C(=O)N(c3ccccc3)c3ccccc3N(C3CC4CCC3C4)C2=O)c1 | 10.1021/jm990967h | ||
10747623 | 168914 | 0 | None | -29 | 2 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 746 | 12 | 6 | 5 | 6.1 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCCc2c[nH]c3ccccc23)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL443028 | 168914 | 0 | None | -29 | 2 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 746 | 12 | 6 | 5 | 6.1 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCCc2c[nH]c3ccccc23)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
44451519 | 95313 | 0 | None | -58 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 518 | 6 | 1 | 4 | 6.1 | Cc1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL258486 | 95313 | 0 | None | -58 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 518 | 6 | 1 | 4 | 6.1 | Cc1cccc(NC(=O)CN2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3N(C3CCCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
10579091 | 14257 | 0 | None | -398 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 577 | 6 | 2 | 4 | 6.2 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL120021 | 14257 | 0 | None | -398 | 2 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 577 | 6 | 2 | 4 | 6.2 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
44265914 | 204952 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 363 | 5 | 1 | 1 | 5.7 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1 | 10.1021/jm00084a009 | ||
CHEMBL8949 | 204952 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 363 | 5 | 1 | 1 | 5.7 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1 | 10.1021/jm00084a009 | ||
16732162 | 141561 | 0 | None | -1862 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 584 | 8 | 2 | 6 | 6.4 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3ccc(C(=O)O)o3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL388144 | 141561 | 0 | None | -1862 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 584 | 8 | 2 | 6 | 6.4 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3ccc(C(=O)O)o3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
10004216 | 4675 | 0 | None | -11 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL103750 | 4675 | 0 | None | -11 | 2 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 456 | 6 | 2 | 3 | 4.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
44346255 | 116381 | 0 | None | -30 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 564 | 6 | 2 | 7 | 6.7 | CC(C)(C1CCCC1)N1C(=O)C(NC(=O)Nc2cccc(C3N=NN=N3)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL338278 | 116381 | 0 | None | -30 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 564 | 6 | 2 | 7 | 6.7 | CC(C)(C1CCCC1)N1C(=O)C(NC(=O)Nc2cccc(C3N=NN=N3)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
19700643 | 63688 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1807152 | 63688 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 505 | 9 | 2 | 4 | 4.5 | CCN(CC)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CC2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
135423404 | 85087 | 0 | None | -4365 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 570 | 8 | 2 | 7 | 5.0 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C2CCCC2)C1=O)Nc1cccc(-c2noc(=O)[nH]2)c1 | 10.1021/jm070139l | ||
CHEMBL227276 | 85087 | 0 | None | -4365 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 570 | 8 | 2 | 7 | 5.0 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C2CCCC2)C1=O)Nc1cccc(-c2noc(=O)[nH]2)c1 | 10.1021/jm070139l | ||
5311201 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00048a001 | ||
CHEMBL9387 | 205663 | 30 | None | -2570 | 6 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 398 | 3 | 2 | 3 | 4.0 | Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1 | 10.1021/jm00048a001 | ||
115208 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm950423p | ||
1667 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm950423p | ||
CHEMBL169703 | 3758 | 25 | None | -91 | 4 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 393 | 4 | 1 | 4 | 4.0 | O=C(c1ccsc1)NCC1CN=C(c2c(N1C)cccc2)c1ccccc1F | 10.1021/jm950423p | ||
44346126 | 15097 | 0 | None | -27 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 514 | 4 | 2 | 3 | 5.7 | O=C(Nc1cccc(Cl)c1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2CC3CCC2C3)C1=O | 10.1021/jm990967h | ||
CHEMBL121267 | 15097 | 0 | None | -27 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 514 | 4 | 2 | 3 | 5.7 | O=C(Nc1cccc(Cl)c1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2CC3CCC2C3)C1=O | 10.1021/jm990967h | ||
10792618 | 163801 | 0 | None | -70 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 543 | 7 | 2 | 4 | 5.7 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL421271 | 163801 | 0 | None | -70 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 543 | 7 | 2 | 4 | 5.7 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)c1 | 10.1021/jm990967h | ||
44265917 | 205880 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 364 | 5 | 1 | 2 | 5.1 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 | 10.1021/jm00084a009 | ||
CHEMBL9510 | 205880 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 364 | 5 | 1 | 2 | 5.1 | O=C(NCC=C(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 | 10.1021/jm00084a009 | ||
9850043 | 112375 | 1 | None | -446 | 3 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL330977 | 112375 | 1 | None | -446 | 3 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
10603576 | 14346 | 0 | None | -19 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 594 | 8 | 2 | 7 | 5.6 | CC(C)Cn1nnc(-c2cccc(NC(=O)NC3C(=O)N(CCC(C)(C)C)c4ccccc4N(c4ccccc4)C3=O)c2)n1 | 10.1021/jm990967h | ||
CHEMBL120168 | 14346 | 0 | None | -19 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 594 | 8 | 2 | 7 | 5.6 | CC(C)Cn1nnc(-c2cccc(NC(=O)NC3C(=O)N(CCC(C)(C)C)c4ccccc4N(c4ccccc4)C3=O)c2)n1 | 10.1021/jm990967h | ||
10747599 | 25656 | 0 | None | -46 | 2 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 743 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCc2cccc3ccccc23)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL135350 | 25656 | 0 | None | -46 | 2 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 743 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCc2cccc3ccccc23)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
13605417 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00084a009 | ||
CHEMBL9485 | 205834 | 3 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 458 | 14 | 2 | 3 | 5.2 | CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00084a009 | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10507109 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL321761 | 108740 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 561 | 7 | 2 | 4 | 5.3 | CC(C)N(C(=O)CN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1 | 10.1016/j.bmc.2007.12.047 | ||
11512151 | 195111 | 0 | None | 158 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 534 | 7 | 2 | 6 | 5.5 | CC(C)(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL565511 | 195111 | 0 | None | 158 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 534 | 7 | 2 | 6 | 5.5 | CC(C)(CNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.064 | ||
44328951 | 164045 | 0 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 533 | 5 | 2 | 4 | 3.8 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
CHEMBL421575 | 164045 | 0 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 533 | 5 | 2 | 4 | 3.8 | O=C(Nc1ccc(F)cc1)NC1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(c2ccccc2F)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
11556194 | 195882 | 0 | None | -3 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 598 | 8 | 3 | 7 | 5.4 | C[C@H](c1ccc(Cl)c(Cl)c1)[C@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL570297 | 195882 | 0 | None | -3 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 598 | 8 | 3 | 7 | 5.4 | C[C@H](c1ccc(Cl)c(Cl)c1)[C@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O | 10.1016/j.bmcl.2009.09.064 | ||
9832467 | 143761 | 0 | None | -602 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 477 | 7 | 3 | 4 | 5.9 | O=C(O)c1cccc(NC(=O)c2nc(C3CCCCC3)[nH]c2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm070880t | ||
CHEMBL390519 | 143761 | 0 | None | -602 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 477 | 7 | 3 | 4 | 5.9 | O=C(O)c1cccc(NC(=O)c2nc(C3CCCCC3)[nH]c2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm070880t | ||
11555110 | 11861 | 0 | None | -5 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 7 | 5 | 4 | 5.7 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4[nH]ccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1182962 | 11861 | 0 | None | -5 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 7 | 5 | 4 | 5.7 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4[nH]ccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067954 | 11861 | 0 | None | -5 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 500 | 7 | 5 | 4 | 5.7 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccc4[nH]ccc4c3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
44403999 | 12178 | 0 | None | -12 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 619 | 10 | 5 | 5 | 5.2 | O=C(O)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm049069y | ||
CHEMBL1184841 | 12178 | 0 | None | -12 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 619 | 10 | 5 | 5 | 5.2 | O=C(O)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm049069y | ||
CHEMBL2067962 | 12178 | 0 | None | -12 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 619 | 10 | 5 | 5 | 5.2 | O=C(O)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm049069y | ||
11605951 | 12180 | 0 | None | -25 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 512 | 8 | 4 | 3 | 6.5 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184851 | 12180 | 0 | None | -25 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 512 | 8 | 4 | 3 | 6.5 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067961 | 12180 | 0 | None | -25 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 512 | 8 | 4 | 3 | 6.5 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
73356071 | 88956 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL2369818 | 88956 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 896 | 26 | 9 | 9 | 2.1 | CCCC[C@H](NC(=O)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||
CHEMBL382349 | 210555 | 0 | None | -3235 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
56663145 | 63813 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 541 | 8 | 2 | 5 | 3.9 | Cc1cccc(Cl)c1NC(=O)NC1C(=O)N(CCC(C)C)c2ccccc2N(CCN2CCOCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808407 | 63813 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 541 | 8 | 2 | 5 | 3.9 | Cc1cccc(Cl)c1NC(=O)NC1C(=O)N(CCC(C)C)c2ccccc2N(CCN2CCOCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
19700618 | 63814 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 523 | 9 | 2 | 6 | 2.9 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)cc1 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808408 | 63814 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 523 | 9 | 2 | 6 | 2.9 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)cc1 | 10.1016/j.bmc.2011.05.057 | ||
118719287 | 114985 | 0 | None | -6 | 2 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 727 | 17 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cccc2ccccc12)N(C)C)C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||
CHEMBL3351059 | 114985 | 0 | None | -6 | 2 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 727 | 17 | 4 | 7 | 4.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1cccc2ccccc12)N(C)C)C(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||
CHEMBL3142842 | 209389 | 0 | None | -2 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
11518283 | 165607 | 0 | None | -74 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 461 | 7 | 3 | 3 | 6.2 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL426290 | 165607 | 0 | None | -74 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 461 | 7 | 3 | 3 | 6.2 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
10482868 | 106920 | 0 | None | -37 | 5 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL317999 | 106920 | 0 | None | -37 | 5 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 557 | 10 | 3 | 4 | 5.2 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
11613212 | 71757 | 0 | None | -39 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 513 | 7 | 3 | 4 | 6.4 | Cc1cc(C)c(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(COC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
CHEMBL197780 | 71757 | 0 | None | -39 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 513 | 7 | 3 | 4 | 6.4 | Cc1cc(C)c(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(COC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
56666597 | 63812 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 585 | 8 | 2 | 5 | 4.0 | Cc1cc(Br)ccc1NC(=O)NC1C(=O)N(CCC(C)C)c2ccccc2N(CCN2CCOCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808405 | 63812 | 0 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 585 | 8 | 2 | 5 | 4.0 | Cc1cc(Br)ccc1NC(=O)NC1C(=O)N(CCC(C)C)c2ccccc2N(CCN2CCOCC2)C1=O | 10.1016/j.bmc.2011.05.057 | ||
118719284 | 114983 | 0 | None | -72 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 739 | 15 | 5 | 7 | 4.9 | CN(C)[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)C1CCCCC1 | 10.1021/jm00053a022 | ||
CHEMBL3351056 | 114983 | 0 | None | -72 | 2 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 739 | 15 | 5 | 7 | 4.9 | CN(C)[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)C1CCCCC1 | 10.1021/jm00053a022 | ||
16733185 | 141560 | 0 | None | -346 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 594 | 8 | 2 | 5 | 6.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3cccc(C(=O)O)c3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL388143 | 141560 | 0 | None | -346 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 594 | 8 | 2 | 5 | 6.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3cccc(C(=O)O)c3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
16732164 | 142771 | 0 | None | -1862 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 571 | 8 | 2 | 6 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3ccn(CC(=O)O)c3c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL389711 | 142771 | 0 | None | -1862 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 571 | 8 | 2 | 6 | 5.5 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3ccn(CC(=O)O)c3c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
10623068 | 112343 | 0 | None | -89 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 6 | 2 | 3 | 4.7 | CCCCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL330854 | 112343 | 0 | None | -89 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 6 | 2 | 3 | 4.7 | CCCCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL1172246 | 206839 | 0 | None | 1 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | None | None | None | N=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CC(=O)NCCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc2ccccc2)C(N)=O)NC(=O)[C@H](Cc2cc3ccccc3[nH]2)NC1=O | 10.1016/j.bmcl.2010.05.078 | ||||
44408483 | 168363 | 0 | None | -165 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.7 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL438739 | 168363 | 0 | None | -165 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.7 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC2C3CC4CC(C3)CC2C4)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
11511706 | 71917 | 0 | None | -12 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 501 | 7 | 3 | 3 | 6.6 | Cc1ccccc1-c1nc(C(=O)Nc2ccc(F)c(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL198225 | 71917 | 0 | None | -12 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 501 | 7 | 3 | 3 | 6.6 | Cc1ccccc1-c1nc(C(=O)Nc2ccc(F)c(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
11571142 | 135283 | 0 | None | -346 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 489 | 7 | 3 | 3 | 6.7 | CC1(c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)CCCCC1 | 10.1021/jm0490686 | ||
CHEMBL373050 | 135283 | 0 | None | -346 | 3 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 489 | 7 | 3 | 3 | 6.7 | CC1(c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)CCCCC1 | 10.1021/jm0490686 | ||
9832467 | 143761 | 0 | None | -602 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 477 | 7 | 3 | 4 | 5.9 | O=C(O)c1cccc(NC(=O)c2nc(C3CCCCC3)[nH]c2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL390519 | 143761 | 0 | None | -602 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 477 | 7 | 3 | 4 | 5.9 | O=C(O)c1cccc(NC(=O)c2nc(C3CCCCC3)[nH]c2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
10256780 | 112182 | 0 | None | -234 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL330409 | 112182 | 0 | None | -234 | 2 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL262172 | 208783 | 0 | None | -26302 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
10626665 | 10164 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
CHEMBL116127 | 10164 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
11540160 | 71104 | 0 | None | -117 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 3 | 3 | 6.6 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL196133 | 71104 | 0 | None | -117 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 3 | 3 | 6.6 | O=C(O)c1cccc(NC(=O)c2[nH]c(C3CCCCC3)nc2CCC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
16732443 | 85072 | 0 | None | -1202 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 532 | 7 | 2 | 5 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL227147 | 85072 | 0 | None | -1202 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 532 | 7 | 2 | 5 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(C(=O)O)c2)N=C(C2CCCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
135610887 | 85017 | 0 | None | -2951 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 558 | 7 | 2 | 7 | 4.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL226583 | 85017 | 0 | None | -2951 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 558 | 7 | 2 | 7 | 4.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
11656338 | 75592 | 0 | None | -389 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 504 | 7 | 2 | 5 | 5.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CO)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
CHEMBL205198 | 75592 | 0 | None | -389 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 504 | 7 | 2 | 5 | 5.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(CO)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm051219x | ||
10071178 | 74146 | 1 | None | 501 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL202861 | 74146 | 1 | None | 501 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 427 | 7 | 4 | 3 | 3.8 | O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10367509 | 106956 | 0 | None | -14 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 471 | 6 | 3 | 3 | 5.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)Nc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL318238 | 106956 | 0 | None | -14 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 471 | 6 | 3 | 3 | 5.7 | CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)Nc1ccccc1 | 10.1021/jm00072a005 | ||
44331505 | 4287 | 0 | None | -25 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 450 | 8 | 2 | 3 | 4.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL101063 | 4287 | 0 | None | -25 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 450 | 8 | 2 | 3 | 4.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
10794691 | 116561 | 0 | None | 1 | 2 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 684 | 10 | 5 | 4 | 5.3 | O=C(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
CHEMBL339177 | 116561 | 0 | None | 1 | 2 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 684 | 10 | 5 | 4 | 5.3 | O=C(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm00021a019 | ||
11679213 | 133020 | 0 | None | -61 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 497 | 7 | 3 | 3 | 6.8 | Cc1ccc(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
CHEMBL370882 | 133020 | 0 | None | -61 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 497 | 7 | 3 | 3 | 6.8 | Cc1ccc(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
44451522 | 157769 | 0 | None | -26 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 531 | 6 | 1 | 4 | 5.1 | Cc1cccc(NC(=O)CN2C(=O)N(CC(=O)N3CCCC3)c3ccccc3N(C3CCCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL408915 | 157769 | 0 | None | -26 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 531 | 6 | 1 | 4 | 5.1 | Cc1cccc(NC(=O)CN2C(=O)N(CC(=O)N3CCCC3)c3ccccc3N(C3CCCCCC3)C2=O)c1 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL1206334 | 206864 | 0 | None | -1023 | 2 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](N)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL262894 | 206864 | 0 | None | -1023 | 2 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](N)Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
11541048 | 195300 | 0 | None | 7 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | C[C@H](CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL566604 | 195300 | 0 | None | 7 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | C[C@H](CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
44444934 | 154407 | 0 | None | - | 1 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 749 | 16 | 6 | 7 | 4.8 | COc1ccc(CCNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)cc1 | 10.1021/jm070880t | ||
CHEMBL401098 | 154407 | 0 | None | - | 1 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 749 | 16 | 6 | 7 | 4.8 | COc1ccc(CCNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)cc1 | 10.1021/jm070880t | ||
11801315 | 114276 | 0 | None | -50 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 577 | 6 | 2 | 4 | 6.0 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CC3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL333930 | 114276 | 0 | None | -50 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 577 | 6 | 2 | 4 | 6.0 | CN(C)c1cccc(NC(=O)NC2C(=O)N(CC3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
108187 | 913 | 30 | None | -4265 | 5 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm070880t | ||
873 | 913 | 30 | None | -4265 | 5 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm070880t | ||
CHEMBL2062154 | 913 | 30 | None | -4265 | 5 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm070880t | ||
CHEMBL287735 | 913 | 30 | None | -4265 | 5 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 614 | 12 | 5 | 5 | 4.9 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)CCC(=O)O | 10.1021/jm070880t | ||
10698427 | 14385 | 0 | None | -645 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 578 | 6 | 3 | 4 | 5.8 | O=C(Nc1cccc(C(=O)O)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL120363 | 14385 | 0 | None | -645 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 578 | 6 | 3 | 4 | 5.8 | O=C(Nc1cccc(C(=O)O)c1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
10555899 | 112874 | 0 | None | -2344 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 623 | 8 | 5 | 6 | 5.2 | CC(O)C(O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331763 | 112874 | 0 | None | -2344 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 623 | 8 | 5 | 6 | 5.2 | CC(O)C(O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL3351062 | 209797 | 0 | None | -173 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)C(=O)N(C)[C@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
11535277 | 12173 | 0 | None | -10 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 513 | 8 | 4 | 4 | 5.9 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184817 | 12173 | 0 | None | -10 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 513 | 8 | 4 | 4 | 5.9 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067964 | 12173 | 0 | None | -10 | 2 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 513 | 8 | 4 | 4 | 5.9 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
10457639 | 107226 | 0 | None | - | 1 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 474 | 8 | 4 | 2 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(Cl)cc1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL319096 | 107226 | 0 | None | - | 1 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 474 | 8 | 4 | 2 | 5.3 | CC(Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(Cl)cc1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
16732911 | 142684 | 0 | None | -999 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 564 | 9 | 2 | 6 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL389639 | 142684 | 0 | None | -999 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 564 | 9 | 2 | 6 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(SCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
16732017 | 85042 | 0 | None | -6025 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 561 | 9 | 2 | 6 | 5.0 | CN(CC(=O)O)c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm070139l | ||
CHEMBL226726 | 85042 | 0 | None | -6025 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 561 | 9 | 2 | 6 | 5.0 | CN(CC(=O)O)c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm070139l | ||
16732020 | 85085 | 0 | None | -3311 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 571 | 8 | 2 | 8 | 4.7 | CN(c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1)c1nn[nH]n1 | 10.1021/jm070139l | ||
CHEMBL227254 | 85085 | 0 | None | -3311 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 571 | 8 | 2 | 8 | 4.7 | CN(c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1)c1nn[nH]n1 | 10.1021/jm070139l | ||
CHEMBL383458 | 210566 | 0 | None | -10 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
44331468 | 4222 | 0 | None | -16 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 470 | 7 | 2 | 3 | 4.8 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(Cc2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL100685 | 4222 | 0 | None | -16 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 470 | 7 | 2 | 3 | 4.8 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(Cc2ccccc2)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL2370441 | 208106 | 0 | None | -2 | 2 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(S(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm00174a016 | ||||
11542079 | 71378 | 0 | None | -11 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 7 | 3 | 3 | 6.5 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL196580 | 71378 | 0 | None | -11 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 7 | 3 | 3 | 6.5 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1 | 10.1021/jm0490686 | ||
11685703 | 71576 | 0 | None | -25 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 391 | 7 | 3 | 3 | 4.9 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC(C)C)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL197205 | 71576 | 0 | None | -25 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 391 | 7 | 3 | 3 | 4.9 | Cc1ccccc1-c1nc(C(=O)Nc2cccc(C(=O)O)c2)c(CCC(C)C)[nH]1 | 10.1021/jm0490686 | ||
16733307 | 168257 | 0 | None | -1819 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 585 | 8 | 2 | 7 | 5.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(C(=O)O)co3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL437736 | 168257 | 0 | None | -1819 | 2 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 585 | 8 | 2 | 7 | 5.8 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(-c3nc(C(=O)O)co3)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
10697783 | 117130 | 0 | None | -141 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 543 | 7 | 2 | 4 | 5.7 | CN(C)c1ccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)cc1 | 10.1021/jm990967h | ||
CHEMBL340107 | 117130 | 0 | None | -141 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 543 | 7 | 2 | 4 | 5.7 | CN(C)c1ccc(NC(=O)NC2C(=O)N(CCC3CCCC3)c3ccccc3N(c3ccccc3F)C2=O)cc1 | 10.1021/jm990967h | ||
56673429 | 63600 | 0 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 537 | 9 | 2 | 6 | 3.3 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)c(C)c1 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1806517 | 63600 | 0 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 537 | 9 | 2 | 6 | 3.3 | COc1ccc(NC(=O)NC2C(=O)N(CCC(C)C)c3ccccc3N(CCN3CCOCC3)C2=O)c(C)c1 | 10.1016/j.bmc.2011.05.057 | ||
19700612 | 63806 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 493 | 8 | 2 | 5 | 2.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808398 | 63806 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 493 | 8 | 2 | 5 | 2.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
16732594 | 14252 | 0 | None | -2511 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc3c2cnn3CC(=O)O)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL1161950 | 14252 | 0 | None | -2511 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc3c2cnn3CC(=O)O)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL1200187 | 14252 | 0 | None | -2511 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc3c2cnn3CC(=O)O)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44303372 | 200990 | 0 | None | - | 1 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 2.0 | CCCCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)CC(N)CC | 10.1021/jm980521l | ||
CHEMBL61498 | 200990 | 0 | None | - | 1 | Mouse | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 317 | 7 | 2 | 3 | 2.0 | CCCCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)CC(N)CC | 10.1021/jm980521l | ||
10768190 | 112333 | 0 | None | -15 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 6.0 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL330773 | 112333 | 0 | None | -15 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 516 | 6 | 2 | 4 | 6.0 | CSc1cccc(NC(=O)NC2C(=O)N(CCC(C)(C)C)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
53465844 | 69068 | 0 | None | 131 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933104 | 69068 | 0 | None | 131 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
10460632 | 206589 | 0 | None | 43 | 2 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1ccc2ccccc2c1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
CHEMBL99252 | 206589 | 0 | None | 43 | 2 | Guinea pig | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 5.8 | CC(Cc1ccc2ccccc2c1)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccccc1)CC(=O)O | 10.1021/jm00072a005 | ||
10696354 | 112991 | 0 | None | -74 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 488 | 5 | 2 | 3 | 5.5 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL331971 | 112991 | 0 | None | -74 | 2 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 488 | 5 | 2 | 3 | 5.5 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
16100410 | 141266 | 0 | None | -6309 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL386212 | 141266 | 0 | None | -6309 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 1031 | 27 | 13 | 12 | 0.2 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
9850043 | 112064 | 1 | None | -309 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(c2ccccc2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL329984 | 112064 | 1 | None | -309 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N(c2ccccc2)C1=O | 10.1016/S0960-894X(96)00544-6 | ||
9850043 | 112375 | 1 | None | -446 | 3 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL330977 | 112375 | 1 | None | -446 | 3 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.1 | O=C(Nc1ccccc1)NC1C(=O)N(CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
44425005 | 141922 | 0 | None | -79 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 7 | 2 | 5 | 4.2 | CC(C)C1=NN(CC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(CC(=O)C(C)(C)C)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL389019 | 141922 | 0 | None | -79 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 7 | 2 | 5 | 4.2 | CC(C)C1=NN(CC(=O)Nc2cccc(C(=O)O)c2)C(=O)N(CC(=O)C(C)(C)C)c2ccccc21 | 10.1021/jm070139l | ||
136036821 | 95364 | 0 | None | -3 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 602 | 9 | 2 | 7 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CCCC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL258782 | 95364 | 0 | None | -3 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 602 | 9 | 2 | 7 | 5.6 | CC(C)(C)C(=O)CN1C(=O)N(CCCC(=O)Nc2cccc(-c3nc(=O)o[nH]3)c2)C(=O)N(C2CCCCC2)c2ccccc21 | 10.1016/j.bmc.2007.12.047 | ||
9958214 | 114295 | 0 | None | -269 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL333979 | 114295 | 0 | None | -269 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 517 | 7 | 2 | 4 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(c2ccccc2F)c2ccccc21 | 10.1021/jm990967h | ||
11613179 | 71444 | 0 | None | -83 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 511 | 7 | 3 | 3 | 7.1 | Cc1cc(C)c(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
CHEMBL196745 | 71444 | 0 | None | -83 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 511 | 7 | 3 | 3 | 7.1 | Cc1cc(C)c(-c2nc(C(=O)Nc3cccc(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1 | 10.1021/jm0490686 | ||
11555166 | 139300 | 0 | None | -54 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)C[C@H]2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
CHEMBL379902 | 139300 | 0 | None | -54 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 502 | 7 | 2 | 5 | 5.5 | CNc1cccc(NC(=O)C[C@H]2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
44356654 | 27899 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 691 | 9 | 3 | 3 | 7.8 | Cc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1C | 10.1021/jm00021a019 | ||
CHEMBL137308 | 27899 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 691 | 9 | 3 | 3 | 7.8 | Cc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc1C | 10.1021/jm00021a019 | ||
10555899 | 112874 | 0 | None | -2344 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 623 | 8 | 5 | 6 | 5.2 | CC(O)C(O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL331763 | 112874 | 0 | None | -2344 | 2 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 623 | 8 | 5 | 6 | 5.2 | CC(O)C(O)Nc1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
9986662 | 101558 | 6 | None | -977 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 643 | 11 | 6 | 6 | 4.8 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL301777 | 101558 | 6 | None | -977 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 643 | 11 | 6 | 6 | 4.8 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2F)NC(=O)c2cc3[nH]cnc3cc2C(=O)NCC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
44346825 | 114275 | 0 | None | -77 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
CHEMBL333920 | 114275 | 0 | None | -77 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 623 | 8 | 3 | 4 | 4.7 | C[C@@H](NC(=O)C[C@@H]1CCCN1C(=O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3)C(=O)O | 10.1021/jm00048a001 | ||
11802426 | 99819 | 0 | None | -50 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 653 | 8 | 3 | 5 | 6.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1C[C@H](Oc2ccc(Cl)cc2Cl)C[C@@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
CHEMBL289021 | 99819 | 0 | None | -50 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 653 | 8 | 3 | 5 | 6.5 | C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N1C[C@H](Oc2ccc(Cl)cc2Cl)C[C@@H]1C(=O)O | 10.1016/s0960-894x(98)00231-5 | ||
10255015 | 206562 | 0 | None | 4 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 490 | 8 | 4 | 2 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc2ccccc2c1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
CHEMBL99065 | 206562 | 0 | None | 4 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 490 | 8 | 4 | 2 | 5.8 | CC(Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc2ccccc2c1)C(=O)NCCc1ccccc1 | 10.1021/jm00072a005 | ||
44346176 | 112835 | 0 | None | -21 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 6 | 3 | 3 | 6.2 | CC(CC1CCCC1)c1cccc2c1NC(=O)C(NC(=O)Nc1ccccc1)C(=O)N2c1ccccc1 | 10.1021/jm990967h | ||
CHEMBL331651 | 112835 | 0 | None | -21 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 6 | 3 | 3 | 6.2 | CC(CC1CCCC1)c1cccc2c1NC(=O)C(NC(=O)Nc1ccccc1)C(=O)N2c1ccccc1 | 10.1021/jm990967h | ||
11498528 | 72131 | 0 | None | -1096 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 503 | 7 | 3 | 4 | 6.1 | O=C(O)c1cccc(NC(=O)c2[nH]c(C34CCC(CC3)CC4)nc2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL198933 | 72131 | 0 | None | -1096 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 503 | 7 | 3 | 4 | 6.1 | O=C(O)c1cccc(NC(=O)c2[nH]c(C34CCC(CC3)CC4)nc2COC23CC4CC(CC(C4)C2)C3)c1 | 10.1021/jm0490686 | ||
CHEMBL384035 | 210569 | 1 | None | -8 | 4 | Guinea pig | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
CHEMBL428666 | 210569 | 1 | None | -8 | 4 | Guinea pig | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/S0960-894X(00)80678-2 | ||||
9914672 | 108055 | 0 | None | -31 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 5 | 2 | 4 | 3.7 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/j.bmc.2007.12.047 | ||
CHEMBL320141 | 108055 | 0 | None | -31 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 5 | 2 | 4 | 3.7 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/j.bmc.2007.12.047 | ||
11534407 | 195260 | 0 | None | 6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 584 | 8 | 3 | 7 | 4.9 | O=C(N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL566359 | 195260 | 0 | None | 6 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 584 | 8 | 3 | 7 | 4.9 | O=C(N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
11627917 | 195853 | 0 | None | 7 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | CC(CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL570163 | 195853 | 0 | None | 7 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | CC(CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
45487003 | 195913 | 0 | None | 100 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 540 | 7 | 2 | 6 | 5.4 | O=C(NCCc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL570521 | 195913 | 0 | None | 100 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 540 | 7 | 2 | 6 | 5.4 | O=C(NCCc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12 | 10.1016/j.bmcl.2009.09.064 | ||
11584582 | 197190 | 0 | None | 19 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | C[C@@H](CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
CHEMBL584063 | 197190 | 0 | None | 19 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 530 | 7 | 2 | 6 | 4.8 | C[C@@H](CNC(=O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12)c1ccccc1 | 10.1016/j.bmcl.2009.09.064 | ||
9914672 | 108055 | 0 | None | -31 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 5 | 2 | 4 | 3.7 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
CHEMBL320141 | 108055 | 0 | None | -31 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 521 | 5 | 2 | 4 | 3.7 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCC2)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
44329156 | 205900 | 0 | None | -50 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 535 | 5 | 2 | 4 | 4.0 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCCC2)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
CHEMBL95200 | 205900 | 0 | None | -50 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 535 | 5 | 2 | 4 | 4.0 | O=C(Nc1ccc(F)cc1)N[C@H]1C(=O)N(CC(=O)N2CCCC2)c2ccccc2N(C2CCCCCC2)C1=O | 10.1016/S0960-894X(96)00613-0 | ||
11505870 | 72162 | 0 | None | -2 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 526 | 8 | 3 | 4 | 6.6 | Cc1ccccc1-c1nc(CCC23CC4CC(CC(C4)C2)C3)c(C(=O)Nc2ccc(N(C)C)c(C(=O)O)c2)[nH]1 | 10.1021/jm0490686 | ||
CHEMBL199032 | 72162 | 0 | None | -2 | 3 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 526 | 8 | 3 | 4 | 6.6 | Cc1ccccc1-c1nc(CCC23CC4CC(CC(C4)C2)C3)c(C(=O)Nc2ccc(N(C)C)c(C(=O)O)c2)[nH]1 | 10.1021/jm0490686 | ||
10652143 | 94163 | 0 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 679 | 11 | 5 | 6 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3sccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL252150 | 94163 | 0 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 679 | 11 | 5 | 6 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3sccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
11802624 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL2067966 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
CHEMBL301810 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm070880t | ||
44331479 | 4306 | 0 | None | -27 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 494 | 9 | 1 | 5 | 4.7 | CC(C)CCN1C(=O)C(NC(=O)Oc2cccc(N(C)C)c2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL101208 | 4306 | 0 | None | -27 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 494 | 9 | 1 | 5 | 4.7 | CC(C)CCN1C(=O)C(NC(=O)Oc2cccc(N(C)C)c2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
11802624 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067966 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL301810 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
10555325 | 12840 | 0 | None | -45 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 585 | 7 | 2 | 5 | 4.2 | CC(=O)N1[C@H](C(=O)NCC(=O)O)CC(=O)c2ccccc2N(Cc2ccccc2)C(=O)[C@H]1CC12CC3CC(CC(C3)C1)C2 | 10.1021/jm070880t | ||
CHEMBL118930 | 12840 | 0 | None | -45 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 585 | 7 | 2 | 5 | 4.2 | CC(=O)N1[C@H](C(=O)NCC(=O)O)CC(=O)c2ccccc2N(Cc2ccccc2)C(=O)[C@H]1CC12CC3CC(CC(C3)C1)C2 | 10.1021/jm070880t | ||
44272229 | 98291 | 0 | None | - | 1 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1021/jm070880t | ||
CHEMBL278032 | 98291 | 0 | None | - | 1 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 635 | 15 | 6 | 6 | 3.5 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCCc1ccccc1 | 10.1021/jm070880t | ||
16090701 | 141222 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 383 | 4 | 2 | 3 | 3.6 | O=C(c1ccccc1NS(=O)(=O)c1cc2ccccc2[nH]1)N1CCCCC1 | 10.1021/jm060590x | ||
CHEMBL385963 | 141222 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 383 | 4 | 2 | 3 | 3.6 | O=C(c1ccccc1NS(=O)(=O)c1cc2ccccc2[nH]1)N1CCCCC1 | 10.1021/jm060590x | ||
16732755 | 85025 | 0 | None | -10000 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 544 | 8 | 2 | 5 | 5.7 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C2CCCCC2)C1=O)Nc1cccc(C(=O)O)c1 | 10.1021/jm070139l | ||
CHEMBL226622 | 85025 | 0 | None | -10000 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 544 | 8 | 2 | 5 | 5.7 | O=C(CN1N=C(C2CCCCC2)c2ccccc2N(CC(=O)C2CCCCC2)C1=O)Nc1cccc(C(=O)O)c1 | 10.1021/jm070139l | ||
11518254 | 11696 | 0 | None | -31 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 460 | 7 | 4 | 3 | 5.8 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1181918 | 11696 | 0 | None | -31 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 460 | 7 | 4 | 3 | 5.8 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067948 | 11696 | 0 | None | -31 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 460 | 7 | 4 | 3 | 5.8 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
9870515 | 12155 | 0 | None | -63 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 498 | 7 | 4 | 3 | 6.1 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184696 | 12155 | 0 | None | -63 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 498 | 7 | 4 | 3 | 6.1 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067955 | 12155 | 0 | None | -63 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 498 | 7 | 4 | 3 | 6.1 | O=C(O)c1cc(NC(=O)c2cc(-c3ccccc3)[nH]c2CC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
11554414 | 12174 | 0 | None | -7 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 461 | 7 | 4 | 4 | 5.2 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL1184820 | 12174 | 0 | None | -7 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 461 | 7 | 4 | 4 | 5.2 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL2067965 | 12174 | 0 | None | -7 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 461 | 7 | 4 | 4 | 5.2 | O=C(O)c1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2CC2CCCCCC2)cc(C(=O)O)c1 | 10.1021/jm049069y | ||
CHEMBL320868 | 209483 | 0 | None | 70 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm990252e | ||||
CHEMBL3351060 | 209795 | 0 | None | 20 | 2 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)c1ccccc1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
4627 | 809 | 44 | None | -1 | 5 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00389a002 | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00389a002 | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00389a002 | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00389a002 | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | None | 10.1021/jm00389a002 | ||||
10027864 | 106798 | 0 | None | - | 1 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccc(F)cc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL317081 | 106798 | 0 | None | - | 1 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 474 | 6 | 2 | 3 | 5.1 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2ccc(F)cc21 | 10.1016/0960-894X(95)00528-2 | ||
44265928 | 205544 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 342 | 5 | 2 | 1 | 5.2 | Cc1cccc(NC(=O)NCC=C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00084a009 | ||
CHEMBL9312 | 205544 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 342 | 5 | 2 | 1 | 5.2 | Cc1cccc(NC(=O)NCC=C(c2ccccc2)c2ccccc2)c1 | 10.1021/jm00084a009 | ||
CHEMBL3351049 | 209787 | 0 | None | -2 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | None | None | None | CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)[C@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C | 10.1021/jm00053a022 | ||||
10651325 | 13765 | 0 | None | -275 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 606 | 7 | 2 | 5 | 6.3 | CCOC(=O)c1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
CHEMBL119608 | 13765 | 0 | None | -275 | 2 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 606 | 7 | 2 | 5 | 6.3 | CCOC(=O)c1cccc(NC(=O)NC2C(=O)N(CC34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)c3ccccc3N(c3ccccc3)C2=O)c1 | 10.1021/jm990967h | ||
16732592 | 143050 | 0 | None | -870 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3c(cnn3CC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL389933 | 143050 | 0 | None | -870 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 572 | 8 | 2 | 7 | 4.9 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2ccc3c(cnn3CC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44296980 | 101552 | 0 | None | -9 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 538 | 5 | 2 | 3 | 4.9 | O=C(NCC12CC3CC(CC(C3)C1)C2)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm9508907 | ||
CHEMBL301740 | 101552 | 0 | None | -9 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 538 | 5 | 2 | 3 | 4.9 | O=C(NCC12CC3CC(CC(C3)C1)C2)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm9508907 | ||
44346952 | 113614 | 0 | None | -9 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 538 | 5 | 2 | 3 | 4.8 | O=C(NCC1C2CC3CC(C2)CC1C3)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm00048a001 | ||
CHEMBL332782 | 113614 | 0 | None | -9 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 538 | 5 | 2 | 3 | 4.8 | O=C(NCC1C2CC3CC(C2)CC1C3)C1C2c3ccccc3C(c3ccccc32)C1C(=O)N1CCC[C@@H]1C(=O)O | 10.1021/jm00048a001 | ||
10674395 | 110284 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
CHEMBL326064 | 110284 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 559 | 7 | 3 | 5 | 4.1 | CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@H]12 | 10.1021/jm9703247 | ||
44331489 | 4210 | 0 | None | -32 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 493 | 9 | 2 | 4 | 4.7 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL100618 | 4210 | 0 | None | -32 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 493 | 9 | 2 | 4 | 4.7 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(CCC(C)C)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
10768658 | 114304 | 0 | None | -42 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.0 | O=C(Nc1ccccc1)NC1C(=O)N(CC2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
CHEMBL334020 | 114304 | 0 | None | -42 | 2 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 534 | 5 | 2 | 3 | 6.0 | O=C(Nc1ccccc1)NC1C(=O)N(CC2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)c2ccccc2N(c2ccccc2)C1=O | 10.1021/jm990967h | ||
16100408 | 141259 | 0 | None | -1202 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
CHEMBL386186 | 141259 | 0 | None | -1202 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 1132 | 28 | 13 | 13 | 1.7 | CCCC[C@@H](NC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm061268p | ||
19700621 | 63815 | 0 | None | - | 1 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 509 | 8 | 3 | 6 | 2.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(O)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808409 | 63815 | 0 | None | - | 1 | Rat | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 509 | 8 | 3 | 6 | 2.6 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccc(O)cc2)C(=O)N(CCN2CCOCC2)c2ccccc21 | 10.1016/j.bmc.2011.05.057 | ||
15249830 | 101465 | 0 | None | -15 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 4.9 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm9508907 | ||
CHEMBL301095 | 101465 | 0 | None | -15 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 4.9 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC12CC3CC(CC(C3)C1)C2 | 10.1021/jm9508907 | ||
44347142 | 113632 | 0 | None | -15 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 4.8 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
CHEMBL332873 | 113632 | 0 | None | -15 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 441 | 4 | 2 | 2 | 4.8 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1C2CC3CC(C2)CC1C3 | 10.1021/jm00048a001 | ||
44408632 | 157692 | 0 | None | -3630 | 4 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
CHEMBL408832 | 157692 | 0 | None | -3630 | 4 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 1212 | 31 | 12 | 15 | 3.8 | CCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](Cc1cn(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc12)C(=O)O | 10.1021/jm050851n | ||
11802624 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL2067966 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
CHEMBL301810 | 101566 | 0 | None | -64 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 673 | 11 | 5 | 5 | 6.2 | O=C(O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3cc2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm9508907 | ||
16733463 | 13889 | 0 | None | -1380 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 547 | 9 | 3 | 6 | 5.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(NCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL1197033 | 13889 | 0 | None | -1380 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 547 | 9 | 3 | 6 | 5.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(NCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
CHEMBL559157 | 13889 | 0 | None | -1380 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 547 | 9 | 3 | 6 | 5.0 | CC(C)(C)C(=O)CN1C(=O)N(CC(=O)Nc2cccc(NCC(=O)O)c2)N=C(C2CCCCC2)c2ccccc21 | 10.1021/jm070139l | ||
44346947 | 15126 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 389 | 4 | 2 | 2 | 4.3 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1CCCCC1 | 10.1021/jm00048a001 | ||
CHEMBL121342 | 15126 | 0 | None | 1 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 389 | 4 | 2 | 2 | 4.3 | O=C(O)C1C2c3ccccc3C(c3ccccc32)C1C(=O)NCC1CCCCC1 | 10.1021/jm00048a001 | ||
CHEMBL336381 | 209837 | 0 | None | -354 | 5 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm0303103 | ||||
11584903 | 140208 | 0 | None | -295 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 560 | 10 | 2 | 6 | 5.1 | CNCCN(C)c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
CHEMBL381805 | 140208 | 0 | None | -295 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 560 | 10 | 2 | 6 | 5.1 | CNCCN(C)c1cccc(NC(=O)CN2N=C(C3CCCCC3)c3ccccc3N(CC(=O)C(C)(C)C)C2=O)c1 | 10.1021/jm051219x | ||
10604847 | 193011 | 0 | None | -218 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 711 | 11 | 6 | 10 | 3.8 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
CHEMBL53237 | 193011 | 0 | None | -218 | 2 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 711 | 11 | 6 | 10 | 3.8 | O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
CHEMBL1172252 | 206842 | 0 | None | -12 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1016/j.bmcl.2010.05.078 | ||||
CHEMBL208479 | 207455 | 0 | None | -3 | 4 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
19043361 | 4551 | 0 | None | 162 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 524 | 6 | 2 | 3 | 6.2 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(Cl)c(Cl)cc21 | 10.1016/0960-894X(95)00528-2 | ||
CHEMBL102867 | 4551 | 0 | None | 162 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 524 | 6 | 2 | 3 | 6.2 | CC(C)CCN1C(=O)C(NC(=O)Nc2ccccc2)C(=O)N(c2ccccc2)c2cc(Cl)c(Cl)cc21 | 10.1016/0960-894X(95)00528-2 | ||
44265973 | 205539 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 362 | 5 | 2 | 1 | 5.6 | O=C(NCC=C(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
CHEMBL9308 | 205539 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 362 | 5 | 2 | 1 | 5.6 | O=C(NCC=C(c1ccccc1)c1ccccc1)Nc1ccc(Cl)cc1 | 10.1021/jm00084a009 | ||
CHEMBL408083 | 210951 | 0 | None | -2 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | None | None | None | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 | 10.1021/jm050921q | ||||
46235271 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
CHEMBL2017835 | 73301 | 2 | None | 2 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 649 | 7 | 1 | 6 | 6.7 | Cc1cc(C)cc(C[C@H]2CCCCN2C(=O)CN2C(=O)[C@@H](Cc3n[nH]c4ccccc34)c3nnc(-c4ccccc4)n3-c3ccccc32)c1 | 10.1021/acs.jmedchem.5b01110 | ||
10580503 | 101220 | 0 | None | -234 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 691 | 11 | 6 | 10 | 3.7 | O=C(NCC1CCCCCC1)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1F)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
CHEMBL299387 | 101220 | 0 | None | -234 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 691 | 11 | 6 | 10 | 3.7 | O=C(NCC1CCCCCC1)c1cc2nc[nH]c2cc1C(=O)N[C@@H](Cc1ccccc1F)C(=O)Nc1cc(-c2nn[nH]n2)cc(-c2nn[nH]n2)c1 | 10.1021/jm9508907 | ||
44356430 | 114732 | 0 | None | -70 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
CHEMBL334714 | 114732 | 0 | None | -70 | 2 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 769 | 11 | 5 | 5 | 6.7 | O=C(O)c1cc(NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1 | 10.1021/jm00021a019 | ||
21476261 | 4230 | 0 | None | -169 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 571 | 8 | 2 | 4 | 5.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
CHEMBL100776 | 4230 | 0 | None | -169 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 571 | 8 | 2 | 4 | 5.9 | CC(C)CCN1C(=O)C(NC(=O)Nc2cccc(N(C)C)c2)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21 | 10.1016/S0960-894X(96)00544-6 | ||
44357011 | 116070 | 0 | None | 1 | 2 | Guinea pig | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 779 | 11 | 3 | 7 | 6.8 | COC(=O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)OC)c1 | 10.1021/jm00021a019 | ||
CHEMBL336453 | 116070 | 0 | None | 1 | 2 | Guinea pig | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 779 | 11 | 3 | 7 | 6.8 | COC(=O)c1cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)C2C3c4ccccc4C(c4ccccc43)C2C(=O)NCC23CC4CC(CC(C4)C2)C3)cc(C(=O)OC)c1 | 10.1021/jm00021a019 | ||
44212463 | 63825 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 555 | 7 | 2 | 4 | 4.9 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL1808419 | 63825 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 555 | 7 | 2 | 4 | 4.9 | O=C(Nc1ccccc1)NC1C(=O)N(CCN2CCCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O | 10.1016/j.bmc.2011.05.057 | ||
CHEMBL411271 | 211128 | 0 | None | -630 | 3 | Guinea pig | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm0000416 | ||||
10838957 | 12366 | 0 | None | -151 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 495 | 5 | 2 | 4 | 5.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
CHEMBL118622 | 12366 | 0 | None | -151 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 495 | 5 | 2 | 4 | 5.2 | CC(C)(C)CCN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)C(=O)N(c2ccccc2)c2ccccc21 | 10.1021/jm990967h | ||
44346326 | 112840 | 0 | None | -46 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 588 | 5 | 2 | 7 | 6.5 | O=C(Nc1cccc(C2N=NN=N2)c1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)C1=O | 10.1021/jm990967h | ||
CHEMBL331688 | 112840 | 0 | None | -46 | 2 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 588 | 5 | 2 | 7 | 6.5 | O=C(Nc1cccc(C2N=NN=N2)c1)NC1C(=O)N(c2ccccc2)c2ccccc2N(C2[C@H]3C[C@@H]4C[C@@H](C[C@H]2C4)C3)C1=O | 10.1021/jm990967h | ||
53465843 | 69067 | 0 | None | 1 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL1933103 | 69067 | 0 | None | 1 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 441 | 8 | 4 | 3 | 4.2 | O=C(Nc1ccccc1C(=O)N[C@@H](CCc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1 | 10.1021/jm200438b | ||
CHEMBL382051 | 210546 | 0 | None | -489 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/jm050921q | ||||
CHEMBL3351055 | 209793 | 0 | None | -70 | 2 | Guinea pig | 6.0 | pKi | = | 6 | Binding | ChEMBL | None | None | None | CC(C)(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cccc2ccccc12)c1ccccc1 | 10.1021/jm00053a022 | ||||
2118 | 201792 | 35 | None | - | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | Drug Central | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | ||
CHEMBL661 | 201792 | 35 | None | - | 2 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | Drug Central | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | ||
5556 | 201569 | 26 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | Drug Central | 342 | 1 | 0 | 4 | 4.2 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2 | None | ||
CHEMBL646 | 201569 | 26 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | Drug Central | 342 | 1 | 0 | 4 | 4.2 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2 | None | ||
11954224 | 214174 | 0 | None | - | 59 | Mouse | 8.4 | pIC50 | = | 8.4 | Binding | Drug Central | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | ||
9853654 | 22588 | 37 | None | - | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | None | ||
CHEMBL1328 | 22588 | 37 | None | - | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 767 | 20 | 8 | 9 | 1.5 | CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | None | ||
1614 | 2317 | 60 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
60182 | 2317 | 60 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
892 | 2317 | 60 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
CHEMBL206025 | 2317 | 60 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | None | ||
16129670 | 803 | 0 | None | 3 | 2 | Rat | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 6256771 | ||||
860 | 803 | 0 | None | 3 | 2 | Rat | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 6256771 | ||||
91898395 | 803 | 0 | None | 3 | 2 | Rat | 9.3 | pKd | = | 9.3 | Binding | Guide to Pharmacology | None | None | None | None | 6256771 | ||||
3476 | 1373 | 8 | None | 2 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 3018478 | ||
59751 | 1373 | 8 | None | 2 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 3018478 | ||
878 | 1373 | 8 | None | 2 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 3018478 | ||
CHEMBL39263 | 1373 | 8 | None | 2 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | Guide to Pharmacology | 408 | 3 | 2 | 3 | 3.7 | O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 | 3018478 | ||
4627 | 809 | 44 | None | -1 | 5 | Rat | 8.0 | pKi | = | 8 | Binding | Drug Central | None | None | None | None | None | ||||
864 | 809 | 44 | None | -1 | 5 | Rat | 8.0 | pKi | = | 8 | Binding | Drug Central | None | None | None | None | None | ||||
9833444 | 809 | 44 | None | -1 | 5 | Rat | 8.0 | pKi | = | 8 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Rat | 8.0 | pKi | = | 8 | Binding | Drug Central | None | None | None | None | None | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Rat | 8.0 | pKi | = | 8 | Binding | Drug Central | None | None | None | None | None | ||||
138106885 | 166358 | 71 | None | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | None | ||
36314 | 166358 | 71 | None | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | None | ||
CHEMBL428647 | 166358 | 71 | None | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 853 | 10 | 4 | 14 | 3.7 | CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C | None | ||
4627 | 809 | 44 | None | -2 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
864 | 809 | 44 | None | -2 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
9833444 | 809 | 44 | None | -2 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1121 | 809 | 44 | None | -2 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
DB09142 | 809 | 44 | None | -2 | 5 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
4627 | 809 | 44 | None | -1 | 5 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
864 | 809 | 44 | None | -1 | 5 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
9833444 | 809 | 44 | None | -1 | 5 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
CHEMBL1121 | 809 | 44 | None | -1 | 5 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
DB09142 | 809 | 44 | None | -1 | 5 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | None | None | None | None | None | ||||
859 | 469 | 0 | None | 7943 | 2 | Rat | 10.5 | pKi | None | 10.5 | Binding | Guide to Pharmacology | None | None | None | None | 9476993 | ||||
3074331 | 912 | 0 | None | - | 1 | Rat | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 493 | 6 | 4 | 4 | 4.6 | O=C(N[C@@](C(=O)N[C@H]1CCCC[C@@H]1O)(Cc1c[nH]c2c1cccc2)C)OC12CC3CC(C2)CC(C1)C3 | 9438020 | ||
872 | 912 | 0 | None | - | 1 | Rat | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 493 | 6 | 4 | 4 | 4.6 | O=C(N[C@@](C(=O)N[C@H]1CCCC[C@@H]1O)(Cc1c[nH]c2c1cccc2)C)OC12CC3CC(C2)CC(C1)C3 | 9438020 | ||
132980 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 7969084 | ||
881 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 7969084 | ||
CHEMBL420783 | 2209 | 8 | None | - | 1 | Rat | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 445 | 2 | 2 | 4 | 4.0 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(N2CC3CCC(C2)CC3)c2c(N(C1=O)C)cccc2 | 7969084 | ||
6439414 | 2976 | 11 | None | -2454 | 2 | Rat | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 7516969 | ||
867 | 2976 | 11 | None | -2454 | 2 | Rat | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 7516969 | ||
CHEMBL3351022 | 2976 | 11 | None | -2454 | 2 | Rat | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 7516969 | ||
CHEMBL341460 | 2976 | 11 | None | -2454 | 2 | Rat | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 612 | 11 | 5 | 5 | 4.6 | O=C(N[C@H](c1ccccc1)CNC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)/C=C/C(=O)O | 7516969 | ||
122130 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 7910212 | ||
888 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 7910212 | ||
CHEMBL115121 | 4052 | 33 | None | - | 1 | Rat | 6.8 | pKi | None | 6.8 | Binding | Guide to Pharmacology | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(c1)NC(=O)N[C@@H]1N=C(c2ccccc2)c2c(N(C1=O)CC(=O)c1ccccc1C)cccc2 | 7910212 | ||
65937 | 1376 | 0 | None | - | 1 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 17684117 | ||
834 | 1376 | 0 | None | - | 1 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 17684117 | ||
889 | 1376 | 0 | None | - | 1 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 17684117 | ||
CHEMBL550781 | 1376 | 0 | None | - | 1 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 17684117 | ||
DB04856 | 1376 | 0 | None | - | 1 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 460 | 14 | 2 | 4 | 4.0 | CCCCCN(C(=O)[C@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC | 17684117 | ||
11488979 | 2105 | 0 | None | - | 1 | Human | 8.0 | pKi | None | 8 | Binding | Guide to Pharmacology | 480 | 7 | 1 | 4 | 6.6 | COc1ccc(cc1)n1nc(cc1c1ccc(c(c1)Cl)Cl)C[C@@H](c1cccc(c1)C)C(=O)O | 17684117 | ||
877 | 2105 | 0 | None | - | 1 | Human | 8.0 | pKi | None | 8 | Binding | Guide to Pharmacology | 480 | 7 | 1 | 4 | 6.6 | COc1ccc(cc1)n1nc(cc1c1ccc(c(c1)Cl)Cl)C[C@@H](c1cccc(c1)C)C(=O)O | 17684117 | ||
CHEMBL400111 | 2105 | 0 | None | - | 1 | Human | 8.0 | pKi | None | 8 | Binding | Guide to Pharmacology | 480 | 7 | 1 | 4 | 6.6 | COc1ccc(cc1)n1nc(cc1c1ccc(c(c1)Cl)Cl)C[C@@H](c1cccc(c1)C)C(=O)O | 17684117 | ||
885 | 3787 | 0 | None | 1584 | 2 | Rat | 8.9 | pKi | None | 8.9 | Binding | Guide to Pharmacology | 619 | 10 | 3 | 6 | 5.1 | O=C([C@@H](NC(=O)c1cc2c([nH]1)cccc2)CSc1ncccc1C(=O)O)N1CCN(CC1)C(c1ccccc1)c1ccccc1 | 8730754 | ||
9873836 | 3787 | 0 | None | 1584 | 2 | Rat | 8.9 | pKi | None | 8.9 | Binding | Guide to Pharmacology | 619 | 10 | 3 | 6 | 5.1 | O=C([C@@H](NC(=O)c1cc2c([nH]1)cccc2)CSc1ncccc1C(=O)O)N1CCN(CC1)C(c1ccccc1)c1ccccc1 | 8730754 |