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 |
9827294 | 73517 | 1 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
127046612 | 139220 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798452 | 139220 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
127046614 | 139396 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799578 | 139396 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
127047356 | 139104 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797662 | 139104 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
44288958 | 168162 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43698 | 168162 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
127047440 | 139077 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 542 | 7 | 2 | 8 | 4.4 | COc1cc2nc(N3CCC(N(C)C(=O)[C@H]4CCCN4)CC3)nc(Nc3ccc(Cl)cc3F)c2cc1OC | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797462 | 139077 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 542 | 7 | 2 | 8 | 4.4 | COc1cc2nc(N3CCC(N(C)C(=O)[C@H]4CCCN4)CC3)nc(Nc3ccc(Cl)cc3F)c2cc1OC | 10.1016/j.ejmech.2016.02.058 | ||
127047612 | 139362 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799393 | 139362 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
44288959 | 164755 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42334 | 164755 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
10238794 | 162285 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 473 | 7 | 2 | 6 | 4.3 | O=S(=O)(Nc1ncc(Cl)nc1OCc1ccccc1CO)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172769 | 162285 | 0 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 473 | 7 | 2 | 6 | 4.3 | O=S(=O)(Nc1ncc(Cl)nc1OCc1ccccc1CO)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10195057 | 161947 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 444 | 6 | 1 | 6 | 4.2 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cccnc1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4167445 | 161947 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 444 | 6 | 1 | 6 | 4.2 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cccnc1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
23585443 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
145959198 | 161624 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 369 | 4 | 1 | 5 | 2.9 | COc1nc(F)c(F)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4162364 | 161624 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 369 | 4 | 1 | 5 | 2.9 | COc1nc(F)c(F)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10308720 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
10309893 | 162138 | 2 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4170431 | 162138 | 2 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
44581043 | 187251 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496152 | 187251 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44581068 | 187341 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 513 | 7 | 2 | 9 | 3.7 | COc1cc2nc(N3CCC(N4CCOC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496787 | 187341 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 513 | 7 | 2 | 9 | 3.7 | COc1cc2nc(N3CCC(N4CCOC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
25212472 | 192045 | 0 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL521737 | 192045 | 0 | None | -2 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
59456023 | 86728 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 516 | 8 | 2 | 7 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)=O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326612 | 86728 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 516 | 8 | 2 | 7 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)=O)cccc32)c1 | 10.1021/jm301572h | ||
59456042 | 86730 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 532 | 8 | 3 | 7 | 4.5 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)(C)O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326614 | 86730 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 532 | 8 | 3 | 7 | 4.5 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)(C)O)cccc32)c1 | 10.1021/jm301572h | ||
59456012 | 86731 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 524 | 8 | 2 | 6 | 5.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(F)F)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326615 | 86731 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 524 | 8 | 2 | 6 | 5.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(F)F)cccc32)c1 | 10.1021/jm301572h | ||
71584536 | 86745 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccnc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326628 | 86745 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccnc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
59168189 | 161877 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4166246 | 161877 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
118706823 | 112477 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 429 | 5 | 2 | 5 | 4.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C(C)C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310832 | 112477 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 429 | 5 | 2 | 5 | 4.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C(C)C | 10.1016/j.bmc.2014.05.021 | ||
10309983 | 161564 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 417 | 4 | 1 | 6 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)c(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4161268 | 161564 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 417 | 4 | 1 | 6 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)c(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
145949792 | 162156 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 425 | 5 | 1 | 6 | 3.8 | COc1nc(Br)cnc1NS(=O)(=O)c1sccc1-c1ccccc1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4170786 | 162156 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 425 | 5 | 1 | 6 | 3.8 | COc1nc(Br)cnc1NS(=O)(=O)c1sccc1-c1ccccc1 | 10.1021/acsmedchemlett.7b00315 | ||
137642528 | 157719 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1ccc2c(cnn2C)c1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4088688 | 157719 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1ccc2c(cnn2C)c1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2017.07.052 | ||
137659242 | 158621 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 458 | 6 | 2 | 9 | 2.3 | COc1nn(C)c2nc(NC3COC3)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4098333 | 158621 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 458 | 6 | 2 | 9 | 2.3 | COc1nn(C)c2nc(NC3COC3)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
145955299 | 162039 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 368 | 4 | 1 | 6 | 2.6 | COc1nc(Cl)cnc1NS(=O)(=O)c1ccnc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4168920 | 162039 | 0 | None | - | 1 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 368 | 4 | 1 | 6 | 2.6 | COc1nc(Cl)cnc1NS(=O)(=O)c1ccnc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
155520262 | 169900 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 578 | 7 | 0 | 8 | 5.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(C)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4448901 | 169900 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 578 | 7 | 0 | 8 | 5.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(C)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
71461546 | 83924 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmc.2012.03.069 | ||
CHEMBL2216810 | 83924 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmc.2012.03.069 | ||
25141301 | 185306 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486840 | 185306 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
25141301 | 185306 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL486840 | 185306 | 0 | None | 1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
118706824 | 112478 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 443 | 5 | 2 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1COC1 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310833 | 112478 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 443 | 5 | 2 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1COC1 | 10.1016/j.bmc.2014.05.021 | ||
59456067 | 73533 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018968 | 73533 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
136116031 | 86375 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 490 | 7 | 3 | 7 | 3.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2321924 | 86375 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 490 | 7 | 3 | 7 | 3.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(O)cccc32)c1 | 10.1021/jm301572h | ||
59456019 | 86747 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326630 | 86747 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
10195081 | 161611 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 445 | 6 | 1 | 7 | 3.6 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cncnc1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4162097 | 161611 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 445 | 6 | 1 | 7 | 3.6 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cncnc1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10309206 | 161856 | 5 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 367 | 4 | 1 | 5 | 3.2 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4165939 | 161856 | 5 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 367 | 4 | 1 | 5 | 3.2 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
59168214 | 162487 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 377 | 6 | 1 | 6 | 3.0 | CCOc1cnc(NS(=O)(=O)c2cccc(Cl)c2Cl)c(OC)n1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4175972 | 162487 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 377 | 6 | 1 | 6 | 3.0 | CCOc1cnc(NS(=O)(=O)c2cccc(Cl)c2Cl)c(OC)n1 | 10.1021/acsmedchemlett.7b00315 | ||
134210781 | 177634 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC(C4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4649666 | 177634 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC(C4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
71584537 | 86746 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)n1 | 10.1021/jm301572h | ||
CHEMBL2326629 | 86746 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)n1 | 10.1021/jm301572h | ||
10150948 | 161426 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4159115 | 161426 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)cc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10287210 | 162541 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)cc1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4176859 | 162541 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)cc1 | 10.1021/acsmedchemlett.7b00315 | ||
137652824 | 158215 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 357 | 3 | 1 | 6 | 2.5 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4093994 | 158215 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 357 | 3 | 1 | 6 | 2.5 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
10126022 | 162224 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 349 | 4 | 1 | 6 | 2.1 | COc1nc(Br)cnc1NS(=O)(=O)c1ccsc1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4171873 | 162224 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 349 | 4 | 1 | 6 | 2.1 | COc1nc(Br)cnc1NS(=O)(=O)c1ccsc1 | 10.1021/acsmedchemlett.7b00315 | ||
137632634 | 155851 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 356 | 3 | 1 | 5 | 3.1 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ccnc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4066451 | 155851 | 0 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Functional | ChEMBL | 356 | 3 | 1 | 5 | 3.1 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ccnc21 | 10.1016/j.bmc.2017.07.052 | ||
155543648 | 172622 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(N3CCC(N4CCCCC4)C(C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4522547 | 172622 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(N3CCC(N4CCCCC4)C(C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
70685474 | 73530 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 518 | 8 | 1 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN(C)C(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018965 | 73530 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 518 | 8 | 1 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN(C)C(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44561334 | 175649 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 423 | 5 | 1 | 6 | 4.8 | COc1ccc2c(NC3CCCCCC3)nc(N3CCC(N4CCCC4)CC3)nc2c1 | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL459464 | 175649 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 423 | 5 | 1 | 6 | 4.8 | COc1ccc2c(NC3CCCCCC3)nc(N3CCC(N4CCCC4)CC3)nc2c1 | 10.1016/j.bmc.2008.05.036 | ||
44561260 | 188457 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 384 | 6 | 2 | 6 | 5.1 | COc1cc2nc(NC3CCCC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL509396 | 188457 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 384 | 6 | 2 | 6 | 5.1 | COc1cc2nc(NC3CCCC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44562238 | 186173 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 524 | 8 | 1 | 8 | 5.0 | COc1cc2nc(N3CCCN(CCN4CCCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488855 | 186173 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 524 | 8 | 1 | 8 | 5.0 | COc1cc2nc(N3CCCN(CCN4CCCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
25141301 | 185306 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486840 | 185306 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
16724339 | 185855 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487635 | 185855 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
25141301 | 185306 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL486840 | 185306 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
16724339 | 185855 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL487635 | 185855 | 0 | None | -1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
156013953 | 176633 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 418 | 5 | 0 | 6 | 4.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC(CN(C)C)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4635359 | 176633 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 418 | 5 | 0 | 6 | 4.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC(CN(C)C)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
10416 | 1849 | 23 | None | 309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
46861584 | 1849 | 23 | None | 309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018969 | 1849 | 23 | None | 309 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
44288958 | 168162 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmc.2012.03.069 | ||
CHEMBL43698 | 168162 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmc.2012.03.069 | ||
25141190 | 1124 | 24 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
9478 | 1124 | 24 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL508207 | 1124 | 24 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
44581102 | 187189 | 0 | None | 1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL495736 | 187189 | 0 | None | 1 | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
156017568 | 177247 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 494 | 5 | 0 | 8 | 4.3 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643839 | 177247 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 494 | 5 | 0 | 8 | 4.3 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
59455988 | 86737 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 547 | 10 | 3 | 8 | 3.8 | CN[C@H](C)C(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326620 | 86737 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 547 | 10 | 3 | 8 | 3.8 | CN[C@H](C)C(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1021/jm301572h | ||
59456014 | 86738 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 547 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)N)c1 | 10.1021/jm301572h | ||
CHEMBL2326621 | 86738 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 547 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)N)c1 | 10.1021/jm301572h | ||
59456103 | 86739 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 573 | 9 | 3 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2CCCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326622 | 86739 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 573 | 9 | 3 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2CCCCN2)c1 | 10.1021/jm301572h | ||
58054368 | 86741 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2COCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326624 | 86741 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2COCCN2)c1 | 10.1021/jm301572h | ||
59456058 | 86750 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326633 | 86750 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
56849395 | 86762 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 540 | 9 | 3 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(C)c(F)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326926 | 86762 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 540 | 9 | 3 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(C)c(F)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
10308720 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
10308963 | 161636 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(F)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4162555 | 161636 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(F)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
145951541 | 162160 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 409 | 6 | 1 | 5 | 4.3 | CC(C)COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4170833 | 162160 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 409 | 6 | 1 | 5 | 4.3 | CC(C)COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
44562237 | 186146 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 510 | 8 | 1 | 8 | 4.7 | COc1cc2nc(N3CCCN(CCN4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488691 | 186146 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 510 | 8 | 1 | 8 | 4.7 | COc1cc2nc(N3CCCN(CCN4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
71525425 | 132291 | 0 | None | -446 | 5 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 509 | 8 | 3 | 9 | 2.7 | Cc1ccc(C(Nc2c(Nc3ccc(Cl)c(S(=O)(=O)N(C)C)c3O)c(=O)c2=O)C2(C)COC2)o1 | nan | ||
CHEMBL3701196 | 132291 | 0 | None | -446 | 5 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 509 | 8 | 3 | 9 | 2.7 | Cc1ccc(C(Nc2c(Nc3ccc(Cl)c(S(=O)(=O)N(C)C)c3O)c(=O)c2=O)C2(C)COC2)o1 | nan | ||
59455992 | 73521 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018957 | 73521 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
23585443 | 537 | 7 | None | -16 | 3 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | -16 | 3 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | -16 | 3 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
71584535 | 86744 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cc(CNC(C)=O)ccn1 | 10.1021/jm301572h | ||
CHEMBL2326627 | 86744 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 505 | 8 | 2 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cc(CNC(C)=O)ccn1 | 10.1021/jm301572h | ||
137633709 | 156078 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 373 | 4 | 2 | 6 | 2.5 | COc1n[nH]c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4069103 | 156078 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 373 | 4 | 2 | 6 | 2.5 | COc1n[nH]c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
145955692 | 161945 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1ccccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4167390 | 161945 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 377 | 4 | 1 | 5 | 2.7 | COc1nc(Br)cnc1NS(=O)(=O)c1ccccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
145971718 | 162518 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 453 | 7 | 1 | 5 | 4.5 | CCCCOc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4176441 | 162518 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 453 | 7 | 1 | 5 | 4.5 | CCCCOc1nc(Br)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
118706827 | 112481 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 461 | 7 | 4 | 7 | 2.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C(CO)CO | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310836 | 112481 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 461 | 7 | 4 | 7 | 2.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C(CO)CO | 10.1016/j.bmc.2014.05.021 | ||
137643503 | 157862 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 359 | 3 | 3 | 6 | 2.2 | O=S(=O)(Nc1ncnc2[nH]nc(O)c12)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4090166 | 157862 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 359 | 3 | 3 | 6 | 2.2 | O=S(=O)(Nc1ncnc2[nH]nc(O)c12)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2017.07.052 | ||
155561858 | 175182 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 515 | 5 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4583503 | 175182 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 515 | 5 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134325276 | 174902 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4577319 | 174902 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134211225 | 177351 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 557 | 8 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNC(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4645325 | 177351 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 557 | 8 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNC(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
25141190 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
9478 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL508207 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
25141190 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
9478 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL508207 | 1124 | 24 | None | -1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
44561294 | 172411 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 481 | 7 | 1 | 7 | 5.6 | COc1cc2nc(N3CCC(N(C)C4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL451783 | 172411 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 481 | 7 | 1 | 7 | 5.6 | COc1cc2nc(N3CCC(N(C)C4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44581121 | 187680 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 553 | 10 | 2 | 8 | 5.0 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL499852 | 187680 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 553 | 10 | 2 | 8 | 5.0 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
16724339 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487635 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
16724339 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL487635 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
25212379 | 187279 | 0 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496356 | 187279 | 0 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
16724339 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL487635 | 185855 | 0 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
25212472 | 192045 | 0 | None | 2 | 2 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL521737 | 192045 | 0 | None | 2 | 2 | Mouse | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
59455975 | 86729 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 518 | 8 | 3 | 7 | 4.3 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326613 | 86729 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 518 | 8 | 3 | 7 | 4.3 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)O)cccc32)c1 | 10.1021/jm301572h | ||
71583488 | 86732 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 546 | 9 | 2 | 8 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COC2)c1 | 10.1021/jm301572h | ||
CHEMBL2326616 | 86732 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 546 | 9 | 2 | 8 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COC2)c1 | 10.1021/jm301572h | ||
11244702 | 161783 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 339 | 4 | 1 | 6 | 2.7 | COc1nccnc1NS(=O)(=O)c1scc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4164738 | 161783 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 339 | 4 | 1 | 6 | 2.7 | COc1nccnc1NS(=O)(=O)c1scc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
59168158 | 162001 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1C | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4168237 | 162001 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1C | 10.1021/acsmedchemlett.7b00315 | ||
10215932 | 72780 | 1 | None | -22 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL2011441 | 72780 | 1 | None | -22 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
118706818 | 112473 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 401 | 4 | 2 | 5 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310827 | 112473 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 401 | 4 | 2 | 5 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C | 10.1016/j.bmc.2014.05.021 | ||
118706829 | 112483 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 484 | 5 | 2 | 6 | 2.8 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1CN(C(C)=O)C1 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310838 | 112483 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 484 | 5 | 2 | 6 | 2.8 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1CN(C(C)=O)C1 | 10.1016/j.bmc.2014.05.021 | ||
137643926 | 157680 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 431 | 6 | 2 | 8 | 2.0 | COc1nn(CC(=O)O)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4088207 | 157680 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 431 | 6 | 2 | 8 | 2.0 | COc1nn(CC(=O)O)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
10194488 | 161629 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4162503 | 161629 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
10194274 | 161833 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 397 | 5 | 1 | 6 | 3.2 | CCOc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4165500 | 161833 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 397 | 5 | 1 | 6 | 3.2 | CCOc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
118706820 | 112475 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 415 | 4 | 1 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)n(C)c(=O)n2C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310829 | 112475 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 415 | 4 | 1 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)n(C)c(=O)n2C | 10.1016/j.bmc.2014.05.021 | ||
118706826 | 112480 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 458 | 7 | 2 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2CCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310835 | 112480 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 458 | 7 | 2 | 6 | 3.0 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2CCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
137661320 | 158535 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 355 | 3 | 1 | 4 | 3.7 | Cn1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2ccccc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4097341 | 158535 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 355 | 3 | 1 | 4 | 3.7 | Cn1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2ccccc21 | 10.1016/j.bmc.2017.07.052 | ||
118706819 | 112474 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 401 | 4 | 2 | 5 | 3.0 | COc1cc2[nH]c(=O)n(C)c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310828 | 112474 | 0 | None | - | 1 | Human | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 401 | 4 | 2 | 5 | 3.0 | COc1cc2[nH]c(=O)n(C)c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
23585443 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
59168181 | 161497 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 391 | 5 | 1 | 5 | 3.3 | C#CCOc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4160218 | 161497 | 0 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 391 | 5 | 1 | 5 | 3.3 | C#CCOc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
16724339 | 185855 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487635 | 185855 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
16724339 | 185855 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL487635 | 185855 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44561335 | 175651 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 393 | 4 | 1 | 5 | 4.8 | c1ccc2c(NC3CCCCCC3)nc(N3CCC(N4CCCC4)CC3)nc2c1 | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL459465 | 175651 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 393 | 4 | 1 | 5 | 4.8 | c1ccc2c(NC3CCCCCC3)nc(N3CCC(N4CCCC4)CC3)nc2c1 | 10.1016/j.bmc.2008.05.036 | ||
44561588 | 192956 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL529664 | 192956 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
134210933 | 176932 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 535 | 6 | 1 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(Cc5cnc[nH]5)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4639600 | 176932 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 535 | 6 | 1 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(Cc5cnc[nH]5)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
134225255 | 176751 | 4 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637143 | 176751 | 4 | None | 1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
134211098 | 177470 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 564 | 8 | 0 | 8 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4647117 | 177470 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 564 | 8 | 0 | 8 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
58054516 | 73523 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018959 | 73523 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
44562156 | 186147 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 511 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3cccc(Br)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488704 | 186147 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 511 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3cccc(Br)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44561217 | 188527 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCN(C(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL510375 | 188527 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCN(C(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
134324821 | 170536 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 515 | 5 | 1 | 7 | 4.5 | CC1CN(c2cnc3c(C(N)=O)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4457732 | 170536 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 515 | 5 | 1 | 7 | 4.5 | CC1CN(c2cnc3c(C(N)=O)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
134324770 | 170376 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 509 | 5 | 1 | 7 | 5.2 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1CN | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4455432 | 170376 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 509 | 5 | 1 | 7 | 5.2 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1CN | 10.1021/acs.jmedchem.9b00506 | ||
134225247 | 177089 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 7 | 1 | 8 | 4.6 | COC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641595 | 177089 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 545 | 7 | 1 | 8 | 4.6 | COC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
134325106 | 170685 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 500 | 4 | 0 | 6 | 6.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4460062 | 170685 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 500 | 4 | 0 | 6 | 6.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
25212379 | 187279 | 0 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496356 | 187279 | 0 | None | 2 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44581044 | 192845 | 0 | None | -3 | 2 | Mouse | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL526474 | 192845 | 0 | None | -3 | 2 | Mouse | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
134325169 | 171843 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 472 | 4 | 0 | 6 | 5.4 | CC1CN(c2cnc3cnn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4476671 | 171843 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 472 | 4 | 0 | 6 | 5.4 | CC1CN(c2cnc3cnn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
134211185 | 176579 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 488 | 6 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4634054 | 176579 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 488 | 6 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
25141301 | 185306 | 0 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486840 | 185306 | 0 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
25141301 | 185306 | 0 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL486840 | 185306 | 0 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
156010350 | 176508 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 531 | 7 | 2 | 8 | 3.2 | CNC(=O)c1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633133 | 176508 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 531 | 7 | 2 | 8 | 3.2 | CNC(=O)c1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44562155 | 186049 | 0 | None | 19 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488018 | 186049 | 0 | None | 19 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
102143549 | 112484 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1cc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310839 | 112484 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1cc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
58054475 | 86740 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@H]2COCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326623 | 86740 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@H]2COCCN2)c1 | 10.1021/jm301572h | ||
58597374 | 162030 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 363 | 5 | 2 | 6 | 2.1 | COc1nc(CO)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4168775 | 162030 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 363 | 5 | 2 | 6 | 2.1 | COc1nc(CO)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
134335265 | 174404 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 497 | 4 | 0 | 7 | 5.3 | CC1CN(c2cnc3c(C#N)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4566241 | 174404 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 497 | 4 | 0 | 7 | 5.3 | CC1CN(c2cnc3c(C#N)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
71583704 | 86743 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 518 | 9 | 2 | 8 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC2COC2)c1 | 10.1021/jm301572h | ||
CHEMBL2326626 | 86743 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 518 | 9 | 2 | 8 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC2COC2)c1 | 10.1021/jm301572h | ||
71583039 | 86763 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 474 | 7 | 2 | 6 | 4.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3ccccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326927 | 86763 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 474 | 7 | 2 | 6 | 4.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3ccccc32)c1 | 10.1021/jm301572h | ||
137647817 | 157015 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 5 | 1 | 8 | 2.5 | COc1nn(C2COC2)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4080352 | 157015 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 5 | 1 | 8 | 2.5 | COc1nn(C2COC2)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137653647 | 158498 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 430 | 6 | 2 | 8 | 2.9 | CCNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4096860 | 158498 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 430 | 6 | 2 | 8 | 2.9 | CCNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
137661613 | 158676 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 415 | 5 | 1 | 7 | 3.5 | COc1nn(C(C)C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4098813 | 158676 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 415 | 5 | 1 | 7 | 3.5 | COc1nn(C(C)C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
155518637 | 169754 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 458 | 4 | 0 | 6 | 5.2 | CC(c1ccc(Cl)cc1Cl)n1ncc2ncc(N3CCC(N4CCCCC4)CC3)nc21 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4446924 | 169754 | 0 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 458 | 4 | 0 | 6 | 5.2 | CC(c1ccc(Cl)cc1Cl)n1ncc2ncc(N3CCC(N4CCCCC4)CC3)nc21 | 10.1021/acs.jmedchem.9b00506 | ||
44561137 | 186137 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCC(N(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL488640 | 186137 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCC(N(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
134325016 | 174081 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 513 | 5 | 1 | 8 | 4.3 | C[C@@H]1CN(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)CC[C@@H]1N1CCC[C@H]1CO | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4558456 | 174081 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 513 | 5 | 1 | 8 | 4.3 | C[C@@H]1CN(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)CC[C@@H]1N1CCC[C@H]1CO | 10.1021/acs.jmedchem.9b00506 | ||
59456051 | 73532 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018967 | 73532 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
142450222 | 169107 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 484 | 4 | 1 | 6 | 4.5 | CC(c1ccc(Cl)cc1Cl)n1ncc2ncc(C3=CCN(C(=O)[C@H]4CCCCN4)CC3)nc21 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4437594 | 169107 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 484 | 4 | 1 | 6 | 4.5 | CC(c1ccc(Cl)cc1Cl)n1ncc2ncc(C3=CCN(C(=O)[C@H]4CCCCN4)CC3)nc21 | 10.1021/acs.jmedchem.9b00506 | ||
156010372 | 176534 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 6 | 0 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633494 | 176534 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 508 | 6 | 0 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44562191 | 186174 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 485 | 9 | 2 | 8 | 4.3 | COc1cc2nc(N3CCC(N(C)CCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488857 | 186174 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 485 | 9 | 2 | 8 | 4.3 | COc1cc2nc(N3CCC(N(C)CCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
58834906 | 92212 | 0 | None | -467 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 604 | 8 | 1 | 6 | 6.2 | Cc1nc(Oc2ccc(C(=O)O)cc2)ccc1CN1CCC(N2C(=O)N(C3CCOCC3)C[C@H]2c2cccc(Cl)c2)CC1 | 10.1021/jm401101p | ||
CHEMBL2435853 | 92212 | 0 | None | -467 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 604 | 8 | 1 | 6 | 6.2 | Cc1nc(Oc2ccc(C(=O)O)cc2)ccc1CN1CCC(N2C(=O)N(C3CCOCC3)C[C@H]2c2cccc(Cl)c2)CC1 | 10.1021/jm401101p | ||
134210845 | 177475 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 565 | 8 | 1 | 8 | 3.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4647188 | 177475 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 565 | 8 | 1 | 8 | 3.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44430312 | 86832 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233046 | 86832 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2017.07.052 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1021/jm301572h | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1021/jm301572h | ||
23585443 | 537 | 7 | None | -16 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | -16 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | -16 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
59168106 | 161535 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 397 | 5 | 2 | 6 | 2.7 | COc1nc(CO)c(Cl)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4160846 | 161535 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 397 | 5 | 2 | 6 | 2.7 | COc1nc(CO)c(Cl)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
23585446 | 162306 | 1 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1ncc(F)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4173046 | 162306 | 1 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1ncc(F)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
59168165 | 162441 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 521 | 6 | 1 | 5 | 5.6 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cccc(Br)c1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4175323 | 162441 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 521 | 6 | 1 | 5 | 5.6 | O=S(=O)(Nc1ncc(Cl)nc1OCc1cccc(Br)c1)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
25212472 | 192045 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL521737 | 192045 | 0 | None | -2 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 497 | 7 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
134210626 | 176731 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 593 | 9 | 1 | 8 | 4.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(=O)(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4636749 | 176731 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 593 | 9 | 1 | 8 | 4.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(=O)(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44562189 | 185993 | 0 | None | 7 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487835 | 185993 | 0 | None | 7 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44561333 | 189286 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 423 | 5 | 1 | 6 | 4.8 | COc1ccc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2c1 | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL516936 | 189286 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 423 | 5 | 1 | 6 | 4.8 | COc1ccc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2c1 | 10.1016/j.bmc.2008.05.036 | ||
10308720 | 540 | 35 | None | -4 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | -4 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | -4 | 3 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
59456102 | 73529 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018964 | 73529 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
59456102 | 73529 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2018964 | 73529 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
58054384 | 86723 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 508 | 7 | 2 | 6 | 4.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(Cl)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326608 | 86723 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 508 | 7 | 2 | 6 | 4.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(Cl)cccc32)c1 | 10.1021/jm301572h | ||
71583489 | 86733 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 546 | 9 | 2 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCO2)c1 | 10.1021/jm301572h | ||
CHEMBL2326617 | 86733 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 546 | 9 | 2 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCO2)c1 | 10.1021/jm301572h | ||
59456010 | 86735 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 574 | 9 | 2 | 8 | 4.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCOCC2)c1 | 10.1021/jm301572h | ||
CHEMBL2326619 | 86735 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 574 | 9 | 2 | 8 | 4.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCOCC2)c1 | 10.1021/jm301572h | ||
118706817 | 112472 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 387 | 4 | 3 | 4 | 3.0 | COc1cc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310826 | 112472 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 387 | 4 | 3 | 4 | 3.0 | COc1cc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
23585443 | 537 | 7 | None | -16 | 3 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | -16 | 3 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | -16 | 3 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
59456021 | 86726 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 499 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C#N)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326610 | 86726 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 499 | 7 | 2 | 7 | 4.1 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C#N)cccc32)c1 | 10.1021/jm301572h | ||
137632888 | 155992 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 431 | 7 | 1 | 8 | 2.6 | COCCn1nc(OC)c2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4068045 | 155992 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 431 | 7 | 1 | 8 | 2.6 | COCCn1nc(OC)c2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
137644457 | 157770 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 402 | 4 | 2 | 8 | 2.1 | COc1nn(C)c2nc(N)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4089151 | 157770 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 402 | 4 | 2 | 8 | 2.1 | COc1nn(C)c2nc(N)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137632974 | 155806 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 444 | 6 | 2 | 8 | 3.3 | COc1nn(C)c2nc(NC(C)C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4065904 | 155806 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 444 | 6 | 2 | 8 | 3.3 | COc1nn(C)c2nc(NC(C)C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137652382 | 156852 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 355 | 3 | 1 | 4 | 3.7 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)cccc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4078359 | 156852 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 355 | 3 | 1 | 4 | 3.7 | Cn1ncc2c(NS(=O)(=O)c3cccc(Cl)c3Cl)cccc21 | 10.1016/j.bmc.2017.07.052 | ||
10173173 | 161697 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)ccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4163571 | 161697 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)ccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
145950145 | 162331 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 279 | 6 | 1 | 5 | 1.7 | CCCCS(=O)(=O)Nc1ncc(Cl)nc1OC | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4173424 | 162331 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 279 | 6 | 1 | 5 | 1.7 | CCCCS(=O)(=O)Nc1ncc(Cl)nc1OC | 10.1021/acsmedchemlett.7b00315 | ||
145950218 | 162415 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 399 | 4 | 1 | 6 | 3.5 | CSc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4174872 | 162415 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 399 | 4 | 1 | 6 | 3.5 | CSc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
134325076 | 171619 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 579 | 7 | 1 | 8 | 4.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(N)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4473604 | 171619 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 579 | 7 | 1 | 8 | 4.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(N)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134325041 | 174460 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 502 | 5 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4567398 | 174460 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 502 | 5 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
44561172 | 173138 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 485 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCC(F)CC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL453594 | 173138 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 485 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCC(F)CC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
70685473 | 73515 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018951 | 73515 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44562189 | 185993 | 0 | None | 7 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487835 | 185993 | 0 | None | 7 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
70681287 | 73525 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1CO | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018960 | 73525 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1CO | 10.1016/j.bmcl.2012.02.104 | ||
134335394 | 171776 | 0 | None | 8 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4475665 | 171776 | 0 | None | 8 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
156018849 | 177333 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 513 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4645037 | 177333 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 513 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
134335393 | 169545 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 499 | 5 | 1 | 6 | 5.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(C3=CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4443688 | 169545 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 499 | 5 | 1 | 6 | 5.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(C3=CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
44562192 | 185195 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 499 | 10 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N(C)CCCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486656 | 185195 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 499 | 10 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N(C)CCCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
134211221 | 177114 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 7 | 1 | 7 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641873 | 177114 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 502 | 7 | 1 | 7 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
134325003 | 174810 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 543 | 7 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4575089 | 174810 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 543 | 7 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
156015374 | 177041 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 551 | 6 | 0 | 7 | 5.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4640909 | 177041 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 551 | 6 | 0 | 7 | 5.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
16041411 | 92144 | 0 | None | -4168 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 572 | 8 | 1 | 6 | 5.6 | O=C(O)c1ccc(Sc2ccc(CN3CCC(N4C(=O)N(C5CCOCC5)C[C@H]4c4ccccc4)CC3)cn2)cc1 | 10.1021/jm401101p | ||
CHEMBL2434978 | 92144 | 0 | None | -4168 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 572 | 8 | 1 | 6 | 5.6 | O=C(O)c1ccc(Sc2ccc(CN3CCC(N4C(=O)N(C5CCOCC5)C[C@H]4c4ccccc4)CC3)cn2)cc1 | 10.1021/jm401101p | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
155557193 | 173953 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 538 | 5 | 1 | 7 | 6.0 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(C)(C)O | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4555534 | 173953 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 538 | 5 | 1 | 7 | 6.0 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(C)(C)O | 10.1021/acs.jmedchem.9b00506 | ||
70689680 | 73519 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018955 | 73519 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
25141190 | 1124 | 24 | None | 1 | 2 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
9478 | 1124 | 24 | None | 1 | 2 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL508207 | 1124 | 24 | None | 1 | 2 | Mouse | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.11.020 | ||
10416 | 1849 | 23 | None | 309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
46861584 | 1849 | 23 | None | 309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
CHEMBL2018969 | 1849 | 23 | None | 309 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
59456111 | 86734 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 560 | 9 | 2 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCCO2)c1 | 10.1021/jm301572h | ||
CHEMBL2326618 | 86734 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 560 | 9 | 2 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCCO2)c1 | 10.1021/jm301572h | ||
59456026 | 86748 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326631 | 86748 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
59455990 | 86749 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326632 | 86749 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
10288569 | 161491 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 4 | 1 | 6 | 3.5 | COc1nc(Br)cnc1NS(=O)(=O)c1sc(Cl)cc1Br | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4160139 | 161491 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 461 | 4 | 1 | 6 | 3.5 | COc1nc(Br)cnc1NS(=O)(=O)c1sc(Cl)cc1Br | 10.1021/acsmedchemlett.7b00315 | ||
10287192 | 161507 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 377 | 5 | 2 | 6 | 2.4 | COc1nc(CO)c(C)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4160463 | 161507 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 377 | 5 | 2 | 6 | 2.4 | COc1nc(CO)c(C)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10193586 | 162272 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1nc(C)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172568 | 162272 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1nc(C)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
44581103 | 187190 | 0 | None | -6 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 539 | 9 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL495737 | 187190 | 0 | None | -6 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 539 | 9 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
118706828 | 112482 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 442 | 5 | 3 | 6 | 2.6 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1CNC1 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310837 | 112482 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 442 | 5 | 3 | 6 | 2.6 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2C1CNC1 | 10.1016/j.bmc.2014.05.021 | ||
56848673 | 86759 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 576 | 9 | 3 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)c(Cl)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326923 | 86759 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 576 | 9 | 3 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)c(Cl)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
56848670 | 86761 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 576 | 9 | 3 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326925 | 86761 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 576 | 9 | 3 | 7 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
118706825 | 112479 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 429 | 6 | 2 | 5 | 3.9 | CCCn1c(=O)[nH]c2cc(NS(=O)(=O)c3cccc(Cl)c3Cl)c(OC)cc21 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310834 | 112479 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 429 | 6 | 2 | 5 | 3.9 | CCCn1c(=O)[nH]c2cc(NS(=O)(=O)c3cccc(Cl)c3Cl)c(OC)cc21 | 10.1016/j.bmc.2014.05.021 | ||
137656805 | 159179 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 444 | 7 | 1 | 8 | 2.5 | COc1nn(CCN(C)C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4104585 | 159179 | 0 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 444 | 7 | 1 | 8 | 2.5 | COc1nn(CCN(C)C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
10417 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
134324842 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4459231 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
155541406 | 172426 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 525 | 6 | 0 | 7 | 6.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC#N)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4518040 | 172426 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 525 | 6 | 0 | 7 | 6.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC#N)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
58054487 | 73528 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 504 | 7 | 1 | 7 | 4.3 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(=O)N(C)C)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018963 | 73528 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 504 | 7 | 1 | 7 | 4.3 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(=O)N(C)C)c1 | 10.1016/j.bmcl.2012.02.104 | ||
134211126 | 176995 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 515 | 7 | 1 | 7 | 4.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(N)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4640439 | 176995 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 515 | 7 | 1 | 7 | 4.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(N)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
155531126 | 171041 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4465359 | 171041 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
44581043 | 187251 | 0 | None | -1 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496152 | 187251 | 0 | None | -1 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44562191 | 186174 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 485 | 9 | 2 | 8 | 4.3 | COc1cc2nc(N3CCC(N(C)CCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488857 | 186174 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 485 | 9 | 2 | 8 | 4.3 | COc1cc2nc(N3CCC(N(C)CCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44581042 | 187250 | 0 | None | -6 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496151 | 187250 | 0 | None | -6 | 2 | Mouse | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44581102 | 187189 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL495736 | 187189 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
71555361 | 132803 | 0 | None | -234 | 5 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 564 | 8 | 3 | 10 | 2.4 | Cc1ccc([C@H](Nc2c(Nc3ccc(Cl)c(S(=O)(=O)N4CCN(C)CC4)c3O)c(=O)c2=O)C2(C)COC2)o1 | nan | ||
CHEMBL3704573 | 132803 | 0 | None | -234 | 5 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 564 | 8 | 3 | 10 | 2.4 | Cc1ccc([C@H](Nc2c(Nc3ccc(Cl)c(S(=O)(=O)N4CCN(C)CC4)c3O)c(=O)c2=O)C2(C)COC2)o1 | nan | ||
134210778 | 177128 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4642090 | 177128 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
118706821 | 112476 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 444 | 6 | 3 | 6 | 1.9 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2CC(N)=O | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310830 | 112476 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 444 | 6 | 3 | 6 | 1.9 | COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1Cl)[nH]c(=O)n2CC(N)=O | 10.1016/j.bmc.2014.05.021 | ||
134336138 | 176921 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 527 | 7 | 1 | 8 | 4.2 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4639418 | 176921 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 527 | 7 | 1 | 8 | 4.2 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
134324973 | 169819 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4447900 | 169819 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
70693879 | 73074 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CO)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2016602 | 73074 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CO)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
44581042 | 187250 | 0 | None | 6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496151 | 187250 | 0 | None | 6 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44561561 | 178423 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 439 | 6 | 1 | 7 | 4.5 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL470962 | 178423 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 439 | 6 | 1 | 7 | 4.5 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
10215932 | 72780 | 1 | None | 22 | 2 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL2011441 | 72780 | 1 | None | 22 | 2 | Mouse | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2014.05.021 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2017.07.052 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1021/jm301572h | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1021/jm301572h | ||
118706831 | 112486 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 389 | 4 | 3 | 6 | 1.8 | COc1nc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310841 | 112486 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 389 | 4 | 3 | 6 | 1.8 | COc1nc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
56848674 | 86760 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 542 | 9 | 3 | 7 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326924 | 86760 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 542 | 9 | 3 | 7 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
59168115 | 161746 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1ncc(C)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4164247 | 161746 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 347 | 4 | 1 | 5 | 2.9 | COc1ncc(C)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
44430315 | 11761 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL1182360 | 11761 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233047 | 11761 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
11223594 | 70740 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195298 | 70740 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
10308720 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
10308720 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | -4 | 3 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
137638825 | 156328 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 430 | 6 | 2 | 8 | 1.4 | COc1nn(CC(N)=O)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4071815 | 156328 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 430 | 6 | 2 | 8 | 1.4 | COc1nn(CC(N)=O)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
59168213 | 161602 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 411 | 5 | 1 | 7 | 2.0 | COc1nc(S(C)(=O)=O)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4161922 | 161602 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 411 | 5 | 1 | 7 | 2.0 | COc1nc(S(C)(=O)=O)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
145955410 | 161847 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 381 | 4 | 1 | 5 | 3.3 | CCc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4165828 | 161847 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 381 | 4 | 1 | 5 | 3.3 | CCc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
10309892 | 161916 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4167021 | 161916 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1 | 10.1021/acsmedchemlett.7b00315 | ||
156018931 | 177295 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 540 | 6 | 0 | 6 | 6.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4644412 | 177295 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 540 | 6 | 0 | 6 | 6.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44581043 | 187251 | 0 | None | 1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496152 | 187251 | 0 | None | 1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 511 | 7 | 1 | 8 | 5.1 | COc1cc2nc(N3CCC(N4CCCC(OC)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44561363 | 189092 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 466 | 6 | 1 | 6 | 6.3 | COc1cc2nc(C3CCN(C4CCCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL515355 | 189092 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 466 | 6 | 1 | 6 | 6.3 | COc1cc2nc(C3CCN(C4CCCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44581044 | 192845 | 0 | None | 3 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL526474 | 192845 | 0 | None | 3 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
11496063 | 76766 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207642 | 76766 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
155540774 | 171947 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 523 | 5 | 1 | 7 | 4.7 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(N)=O | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4483537 | 171947 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 523 | 5 | 1 | 7 | 4.7 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(N)=O | 10.1021/acs.jmedchem.9b00506 | ||
155543069 | 172617 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 459 | 5 | 2 | 5 | 4.7 | C[C@@H](Nc1cncc(C2=CCN(C(=O)[C@H]3CCCCN3)CC2)n1)c1ccc(Cl)cc1Cl | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4522437 | 172617 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 459 | 5 | 2 | 5 | 4.7 | C[C@@H](Nc1cncc(C2=CCN(C(=O)[C@H]3CCCCN3)CC2)n1)c1ccc(Cl)cc1Cl | 10.1021/acs.jmedchem.9b00506 | ||
59456003 | 73516 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018952 | 73516 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44562235 | 185878 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 495 | 6 | 1 | 7 | 5.9 | COc1cc2nc(N3CCCN(C4CCCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487665 | 185878 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 495 | 6 | 1 | 7 | 5.9 | COc1cc2nc(N3CCCN(C4CCCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44561332 | 175648 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCN(C4CCCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL459463 | 175648 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCN(C4CCCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
58835024 | 92211 | 0 | None | -398 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 570 | 8 | 1 | 6 | 5.5 | Cc1nc(Oc2ccc(C(=O)O)cc2)ccc1CN1CCC(N2C(=O)N(C3CCOCC3)C[C@H]2c2ccccc2)CC1 | 10.1021/jm401101p | ||
CHEMBL2435852 | 92211 | 0 | None | -398 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 570 | 8 | 1 | 6 | 5.5 | Cc1nc(Oc2ccc(C(=O)O)cc2)ccc1CN1CCC(N2C(=O)N(C3CCOCC3)C[C@H]2c2ccccc2)CC1 | 10.1021/jm401101p | ||
134324891 | 173995 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 458 | 4 | 0 | 6 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4556507 | 173995 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 458 | 4 | 0 | 6 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
25212379 | 187279 | 0 | None | -2 | 2 | Mouse | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496356 | 187279 | 0 | None | -2 | 2 | Mouse | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 511 | 7 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
134210775 | 177202 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 530 | 7 | 0 | 8 | 4.8 | CCOC(=O)CN1CCCC(C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643066 | 177202 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 530 | 7 | 0 | 8 | 4.8 | CCOC(=O)CN1CCCC(C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
134211057 | 177051 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 529 | 7 | 1 | 7 | 4.3 | CC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641127 | 177051 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 529 | 7 | 1 | 7 | 4.3 | CC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
59455976 | 86727 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 504 | 8 | 3 | 7 | 3.7 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(CO)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326611 | 86727 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 504 | 8 | 3 | 7 | 3.7 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(CO)cccc32)c1 | 10.1021/jm301572h | ||
59456050 | 86742 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 589 | 9 | 2 | 9 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COCCN2C)c1 | 10.1021/jm301572h | ||
CHEMBL2326625 | 86742 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 589 | 9 | 2 | 9 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COCCN2C)c1 | 10.1021/jm301572h | ||
118706816 | 112471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310825 | 112471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2C | 10.1016/j.bmc.2014.05.021 | ||
118706816 | 112471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2C | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL3310825 | 112471 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1cccc(Cl)c1Cl)nn2C | 10.1016/j.bmc.2017.07.052 | ||
44562192 | 185195 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 499 | 10 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N(C)CCCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486656 | 185195 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 499 | 10 | 2 | 8 | 4.7 | COc1cc2nc(N3CCC(N(C)CCCCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44581103 | 187190 | 0 | None | 6 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 539 | 9 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL495737 | 187190 | 0 | None | 6 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 539 | 9 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44581068 | 187341 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 513 | 7 | 2 | 9 | 3.7 | COc1cc2nc(N3CCC(N4CCOC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496787 | 187341 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 513 | 7 | 2 | 9 | 3.7 | COc1cc2nc(N3CCC(N4CCOC(CO)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
137636569 | 155333 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 387 | 4 | 1 | 7 | 2.5 | COc1nn(C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4060413 | 155333 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 387 | 4 | 1 | 7 | 2.5 | COc1nn(C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
10215932 | 72780 | 1 | None | -22 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL2011441 | 72780 | 1 | None | -22 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 383 | 4 | 1 | 6 | 2.8 | COc1nc(Br)cnc1NS(=O)(=O)c1ccc(Cl)s1 | 10.1021/acsmedchemlett.7b00315 | ||
145958908 | 161541 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 401 | 4 | 1 | 5 | 3.6 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(C(F)(F)F)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4160965 | 161541 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 401 | 4 | 1 | 5 | 3.6 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(C(F)(F)F)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
145951136 | 162202 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 358 | 4 | 1 | 6 | 2.5 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1C#N | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4171579 | 162202 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 358 | 4 | 1 | 6 | 2.5 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1C#N | 10.1021/acsmedchemlett.7b00315 | ||
137632086 | 155896 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 4 | 1 | 7 | 2.8 | COc1nn(C)c2nc(C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4066934 | 155896 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 401 | 4 | 1 | 7 | 2.8 | COc1nn(C)c2nc(C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137654717 | 158186 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 430 | 5 | 1 | 8 | 2.5 | COc1nn(C)c2nc(N(C)C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4093509 | 158186 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 430 | 5 | 1 | 8 | 2.5 | COc1nn(C)c2nc(N(C)C)nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137652889 | 158359 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 444 | 6 | 2 | 8 | 1.7 | CNC(=O)Cn1nc(OC)c2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4095437 | 158359 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 444 | 6 | 2 | 8 | 1.7 | CNC(=O)Cn1nc(OC)c2c(NS(=O)(=O)c3cccc(Cl)c3Cl)ncnc21 | 10.1016/j.bmc.2017.07.052 | ||
145951247 | 162378 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1c(Cl)cccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4174254 | 162378 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 411 | 4 | 1 | 5 | 3.4 | COc1nc(Br)cnc1NS(=O)(=O)c1c(Cl)cccc1Cl | 10.1021/acsmedchemlett.7b00315 | ||
10193603 | 162393 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 349 | 4 | 1 | 6 | 2.1 | COc1nc(Br)cnc1NS(=O)(=O)c1cccs1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4174488 | 162393 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 349 | 4 | 1 | 6 | 2.1 | COc1nc(Br)cnc1NS(=O)(=O)c1cccs1 | 10.1021/acsmedchemlett.7b00315 | ||
44581044 | 192845 | 0 | None | 3 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL526474 | 192845 | 0 | None | 3 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 525 | 8 | 1 | 8 | 5.4 | COCC1CCCN(C2CCN(c3nc(Nc4ccc(Cl)cc4)c4cc(OC)c(OC)cc4n3)CC2)C1 | 10.1016/j.bmc.2008.11.020 | ||
692856 | 140831 | 16 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL383736 | 140831 | 16 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
134325269 | 170124 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 516 | 5 | 1 | 7 | 4.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C(=O)O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4451802 | 170124 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 516 | 5 | 1 | 7 | 4.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C(=O)O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134210768 | 176880 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 530 | 8 | 1 | 7 | 5.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4638846 | 176880 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 530 | 8 | 1 | 7 | 5.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
134325215 | 174406 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 472 | 4 | 0 | 6 | 5.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4566304 | 174406 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 472 | 4 | 0 | 6 | 5.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
44562155 | 186049 | 0 | None | 19 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488018 | 186049 | 0 | None | 19 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
44430312 | 86832 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233046 | 86832 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
127047356 | 139104 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797662 | 139104 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
127045756 | 139339 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799266 | 139339 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
127046614 | 139396 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799578 | 139396 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
10287052 | 161828 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 367 | 4 | 1 | 5 | 3.2 | COc1ncc(Cl)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4165356 | 161828 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 367 | 4 | 1 | 5 | 3.2 | COc1ncc(Cl)nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
11234202 | 162353 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 373 | 4 | 1 | 6 | 3.3 | COc1nc(Cl)cnc1NS(=O)(=O)c1scc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4173861 | 162353 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 373 | 4 | 1 | 6 | 3.3 | COc1nc(Cl)cnc1NS(=O)(=O)c1scc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
44562189 | 185993 | 0 | None | -7 | 2 | Mouse | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487835 | 185993 | 0 | None | -7 | 2 | Mouse | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 451 | 6 | 1 | 7 | 4.6 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
156010600 | 176564 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 550 | 7 | 0 | 8 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633920 | 176564 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 550 | 7 | 0 | 8 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
118706830 | 112485 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1nc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310840 | 112485 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1nc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
58054532 | 73527 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 490 | 7 | 2 | 7 | 4.0 | CNC(=O)c1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018962 | 73527 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 490 | 7 | 2 | 7 | 4.0 | CNC(=O)c1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
58054387 | 86724 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 492 | 7 | 2 | 6 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326609 | 86724 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 492 | 7 | 2 | 6 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1 | 10.1021/jm301572h | ||
59456098 | 86751 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1ccc(F)c2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326634 | 86751 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1ccc(F)c2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
137639968 | 156136 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 416 | 5 | 2 | 8 | 2.5 | CNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4069639 | 156136 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 416 | 5 | 2 | 8 | 2.5 | CNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
137639432 | 156288 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 359 | 4 | 1 | 8 | 1.9 | COc1nn(C)c2ncnc(NS(=O)(=O)c3ccc(Cl)s3)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4071299 | 156288 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 359 | 4 | 1 | 8 | 1.9 | COc1nn(C)c2ncnc(NS(=O)(=O)c3ccc(Cl)s3)c12 | 10.1016/j.bmc.2017.07.052 | ||
10308962 | 162493 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1F | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4176082 | 162493 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1F | 10.1021/acsmedchemlett.7b00315 | ||
137634526 | 155388 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 417 | 5 | 1 | 8 | 2.5 | COc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4060967 | 155388 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 417 | 5 | 1 | 8 | 2.5 | COc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
137632304 | 155936 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1nn(C)c2cccc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4067451 | 155936 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 3.7 | COc1nn(C)c2cccc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137647898 | 157199 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 431 | 7 | 1 | 8 | 2.5 | COCCOc1nn(C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4082318 | 157199 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 431 | 7 | 1 | 8 | 2.5 | COCCOc1nn(C)c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
137644970 | 157949 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 387 | 5 | 2 | 6 | 2.9 | CCOc1n[nH]c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4091069 | 157949 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 387 | 5 | 2 | 6 | 2.9 | CCOc1n[nH]c2ncnc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12 | 10.1016/j.bmc.2017.07.052 | ||
59168178 | 162434 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 343 | 4 | 1 | 5 | 2.0 | COc1nc(Br)cnc1NS(=O)(=O)c1ccccc1 | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4175259 | 162434 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 343 | 4 | 1 | 5 | 2.0 | COc1nc(Br)cnc1NS(=O)(=O)c1ccccc1 | 10.1021/acsmedchemlett.7b00315 | ||
137637450 | 155278 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 460 | 8 | 2 | 9 | 2.5 | COCCNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
CHEMBL4059913 | 155278 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 460 | 8 | 2 | 9 | 2.5 | COCCNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1 | 10.1016/j.bmc.2017.07.052 | ||
145955548 | 162062 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 423 | 5 | 1 | 5 | 4.7 | CC(C)(C)COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169258 | 162062 | 0 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 423 | 5 | 1 | 5 | 4.7 | CC(C)(C)COc1nc(Cl)cnc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1021/acsmedchemlett.7b00315 | ||
134225259 | 177170 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 517 | 7 | 2 | 8 | 3.0 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(N)=O)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4642563 | 177170 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 517 | 7 | 2 | 8 | 3.0 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(N)=O)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44430315 | 11761 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL1182360 | 11761 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233047 | 11761 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
155548141 | 173215 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@@H](N4CCCCC4)[C@@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4537681 | 173215 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@@H](N4CCCCC4)[C@@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
44562155 | 186049 | 0 | None | -19 | 2 | Mouse | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488018 | 186049 | 0 | None | -19 | 2 | Mouse | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 469 | 6 | 1 | 7 | 4.7 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(F)c(F)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
134324996 | 171177 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 540 | 4 | 0 | 6 | 6.5 | CC1CN(c2cnc3c(C(F)(F)F)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4467274 | 171177 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 540 | 4 | 0 | 6 | 6.5 | CC1CN(c2cnc3c(C(F)(F)F)nn(C(C)c4ccc(Cl)cc4Cl)c3n2)CCC1N1CCCCC1 | 10.1021/acs.jmedchem.9b00506 | ||
134210954 | 177236 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643609 | 177236 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44581042 | 187250 | 0 | None | 6 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL496151 | 187250 | 0 | None | 6 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 497 | 6 | 2 | 8 | 4.5 | COc1cc2nc(N3CCC(N4CCCC(O)C4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
44581102 | 187189 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
CHEMBL495736 | 187189 | 0 | None | -1 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 525 | 8 | 2 | 8 | 4.6 | COc1cc2nc(N3CCC(N4CCCC(CO)C4)CC3)nc(NCc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.11.020 | ||
156012782 | 176790 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 545 | 7 | 1 | 8 | 3.6 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(=O)N(C)C)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637695 | 176790 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 545 | 7 | 1 | 8 | 3.6 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(=O)N(C)C)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
134210898 | 177209 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 516 | 7 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643158 | 177209 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 516 | 7 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
59455974 | 73526 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018961 | 73526 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44562236 | 186145 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 512 | 10 | 1 | 8 | 4.9 | CCN(CC)CCN1CCCN(c2nc(Nc3ccc(Cl)cc3)c3cc(OC)c(OC)cc3n2)CC1 | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488690 | 186145 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 512 | 10 | 1 | 8 | 4.9 | CCN(CC)CCN1CCCN(c2nc(Nc3ccc(Cl)cc3)c3cc(OC)c(OC)cc3n2)CC1 | 10.1016/j.bmc.2008.07.062 | ||
44562190 | 185994 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 471 | 8 | 2 | 8 | 3.9 | COc1cc2nc(N3CCC(N(C)CCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487836 | 185994 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 471 | 8 | 2 | 8 | 3.9 | COc1cc2nc(N3CCC(N(C)CCO)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
59455974 | 73526 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018961 | 73526 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
59456102 | 73529 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018964 | 73529 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Functional | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
59456003 | 73516 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018952 | 73516 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
59456051 | 73532 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018967 | 73532 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
58054516 | 73523 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018959 | 73523 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
10416 | 1849 | 23 | None | 309 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
46861584 | 1849 | 23 | None | 309 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018969 | 1849 | 23 | None | 309 | 2 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
59456067 | 73533 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018968 | 73533 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
70685473 | 73515 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018951 | 73515 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
70689680 | 73519 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018955 | 73519 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
49798461 | 10593 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 443 | 5 | 1 | 5 | 5.3 | Cc1ncccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
CHEMBL1170725 | 10593 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 443 | 5 | 1 | 5 | 5.3 | Cc1ncccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
49798437 | 10459 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 515 | 8 | 3 | 6 | 4.4 | O=C(NCCO)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
CHEMBL1169660 | 10459 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 515 | 8 | 3 | 6 | 4.4 | O=C(NCCO)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
49798349 | 10691 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 471 | 6 | 2 | 4 | 5.9 | O=C(O)c1ccccc1Oc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
CHEMBL1171786 | 10691 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 471 | 6 | 2 | 4 | 5.9 | O=C(O)c1ccccc1Oc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
16124598 | 10629 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 472 | 6 | 2 | 5 | 5.3 | O=C(O)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
CHEMBL1171008 | 10629 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 472 | 6 | 2 | 5 | 5.3 | O=C(O)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2010.04.142 | ||
12893 | 4076 | 0 | None | - | 1 | Human | 7.0 | pIC50 | < | 7 | Functional | Guide to Pharmacology | 565 | 7 | 2 | 6 | 6.3 | CC1=C(C(=NC(=N1)N2CC(C2)[C@H]3CCCN(C3)C4CC(C4)(C)C(=O)O)N[C@H](C)C5=C(C=C(C=C5)Cl)Cl)Cl | None | ||
139344142 | 4076 | 0 | None | - | 1 | Human | 7.0 | pIC50 | < | 7 | Functional | Guide to Pharmacology | 565 | 7 | 2 | 6 | 6.3 | CC1=C(C(=NC(=N1)N2CC(C2)[C@H]3CCCN(C3)C4CC(C4)(C)C(=O)O)N[C@H](C)C5=C(C=C(C=C5)Cl)Cl)Cl | None | ||
5280343 | 187691 | 119 | None | -16 | 7 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | ||
CHEMBL1520590 | 187691 | 119 | None | -16 | 7 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | ||
CHEMBL50 | 187691 | 119 | None | -16 | 7 | Human | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | ||
2812 | 4711 | 96 | None | 3 | 39 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | ||
CHEMBL104 | 4711 | 96 | None | 3 | 39 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | ||
4410 | 3088 | 99 | None | -18 | 5 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 502 | 4 | 6 | 8 | 0.4 | C1CNCCN(CCCNCCNC1)Cc1ccc(cc1)CN1CCNCCCNCCNCCC1 | None | ||
65015 | 3088 | 99 | None | -18 | 5 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 502 | 4 | 6 | 8 | 0.4 | C1CNCCN(CCCNCCNC1)Cc1ccc(cc1)CN1CCNCCCNCCNCCC1 | None | ||
844 | 3088 | 99 | None | -18 | 5 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 502 | 4 | 6 | 8 | 0.4 | C1CNCCN(CCCNCCNC1)Cc1ccc(cc1)CN1CCNCCCNCCNCCC1 | None | ||
CHEMBL18442 | 3088 | 99 | None | -18 | 5 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 502 | 4 | 6 | 8 | 0.4 | C1CNCCN(CCCNCCNC1)Cc1ccc(cc1)CN1CCNCCCNCCNCCC1 | None | ||
DB06809 | 3088 | 99 | None | -18 | 5 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 502 | 4 | 6 | 8 | 0.4 | C1CNCCN(CCCNCCNC1)Cc1ccc(cc1)CN1CCNCCCNCCNCCC1 | None | ||
3793 | 201519 | 70 | None | -1 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | ||
45039617 | 201519 | 70 | None | -1 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | ||
CHEMBL64391 | 201519 | 70 | None | -1 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | ||
12153 | 1635 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | Guide to Pharmacology | 542 | 6 | 1 | 7 | 4.9 | C[C@H](c1c(cc(cc1)Cl)Cl)n1c2nc(cnc2c(n1)C(F)(F)F)N1CC(C1)[C@H]1CCCN(C1)CCO | None | ||
134210715 | 1635 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | Guide to Pharmacology | 542 | 6 | 1 | 7 | 4.9 | C[C@H](c1c(cc(cc1)Cl)Cl)n1c2nc(cnc2c(n1)C(F)(F)F)N1CC(C1)[C@H]1CCCN(C1)CCO | None | ||
10417 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 31259550 | ||
134324842 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 31259550 | ||
CHEMBL4459231 | 1052 | 5 | None | 3 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 31259550 | ||
10308720 | 540 | 35 | None | -2 | 3 | Dog | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9678 | 540 | 35 | None | -2 | 3 | Dog | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4169247 | 540 | 35 | None | -2 | 3 | Dog | 7.6 | pIC50 | = | 7.6 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
25141190 | 1124 | 24 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 19081254 | ||
9478 | 1124 | 24 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 19081254 | ||
CHEMBL508207 | 1124 | 24 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | Guide to Pharmacology | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 19081254 | ||
10308720 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9678 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4169247 | 540 | 35 | None | -4 | 3 | Human | 7.8 | pIC50 | = | 7.8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
10308720 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9678 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4169247 | 540 | 35 | None | 2 | 3 | Mouse | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
23585443 | 537 | 7 | None | -3 | 3 | Dog | 8.5 | pIC50 | = | 8.5 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9679 | 537 | 7 | None | -3 | 3 | Dog | 8.5 | pIC50 | = | 8.5 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4172635 | 537 | 7 | None | -3 | 3 | Dog | 8.5 | pIC50 | = | 8.5 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
23585443 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9679 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4172635 | 537 | 7 | None | -16 | 3 | Human | 8.6 | pIC50 | = | 8.6 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
797 | 819 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | None | None | None | None | 9430724 | ||||
23585443 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
9679 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
CHEMBL4172635 | 537 | 7 | None | 3 | 3 | Mouse | 9.0 | pIC50 | = | 9 | Functional | Guide to Pharmacology | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 28947948 | ||
798 | 834 | 0 | None | - | 1 | Human | 9.2 | pIC50 | = | 9.2 | Functional | Guide to Pharmacology | None | None | None | None | 9430724 |
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 |
44410965 | 76706 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 283 | 5 | 2 | 4 | 4.1 | CCNCc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207290 | 76706 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 283 | 5 | 2 | 4 | 4.1 | CCNCc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44406335 | 73586 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL202085 | 73586 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
44288732 | 100700 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 596 | 11 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2F)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL295560 | 100700 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 596 | 11 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2F)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288854 | 164509 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42266 | 164509 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44288730 | 165419 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42523 | 165419 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289282 | 169209 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 617 | 11 | 3 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc2[nH]ccc2c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44390 | 169209 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 617 | 11 | 3 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc2[nH]ccc2c1 | 10.1016/j.bmcl.2004.01.072 | ||
5481702 | 204109 | 1 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 5.3 | CN(C[C@@H](CCN1CCC2(CC1)C[S+]([O-])c1ccccc12)c1cccc(Cl)c1)S(=O)(=O)c1ccccc1 | 10.1016/s0960-894x(00)00639-9 | ||
CHEMBL83338 | 204109 | 1 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 5.3 | CN(C[C@@H](CCN1CCC2(CC1)C[S+]([O-])c1ccccc12)c1cccc(Cl)c1)S(=O)(=O)c1ccccc1 | 10.1016/s0960-894x(00)00639-9 | ||
5280343 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL1520590 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL50 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
71720517 | 86579 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
CHEMBL2324200 | 86579 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
44288960 | 163244 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccccc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42060 | 163244 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccccc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44400830 | 70891 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 376 | 10 | 1 | 4 | 5.1 | CCN(CC)CCCC(C)Nc1nc(Cc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195665 | 70891 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 376 | 10 | 1 | 4 | 5.1 | CCN(CC)CCCC(C)Nc1nc(Cc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
5280343 | 187691 | 119 | None | - | 32 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL1520590 | 187691 | 119 | None | - | 32 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL50 | 187691 | 119 | None | - | 32 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
44288899 | 100795 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 588 | 13 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](CCc2ccccc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL296245 | 100795 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 588 | 13 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](CCc2ccccc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288863 | 161522 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 566 | 11 | 2 | 6 | 3.5 | O=C(C[C@H]1S[C@H](C2CCCCC2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL416069 | 161522 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 566 | 11 | 2 | 6 | 3.5 | O=C(C[C@H]1S[C@H](C2CCCCC2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289207 | 167628 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 633 | 9 | 1 | 5 | 6.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(Cc2cccc(CN3CCOCC3)c2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43330 | 167628 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 633 | 9 | 1 | 5 | 6.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(Cc2cccc(CN3CCOCC3)c2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288557 | 169717 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 550 | 11 | 2 | 7 | 2.9 | O=C(C[C@H]1S[C@H](c2ccoc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44463 | 169717 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 550 | 11 | 2 | 7 | 2.9 | O=C(C[C@H]1S[C@H](c2ccoc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
5280343 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL1520590 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
CHEMBL50 | 187691 | 119 | None | - | 32 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | ||
134211221 | 177114 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 502 | 7 | 1 | 7 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641873 | 177114 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 502 | 7 | 1 | 7 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
45104526 | 199025 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 479 | 3 | 3 | 7 | 3.8 | Cc1c(N2CCN(C(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL599995 | 199025 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 479 | 3 | 3 | 7 | 3.8 | Cc1c(N2CCN(C(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
44288959 | 164755 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42334 | 164755 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 640 | 11 | 2 | 5 | 6.3 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44430304 | 151590 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 477 | 12 | 2 | 7 | 5.7 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2c(ncn2CC)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL396786 | 151590 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 477 | 12 | 2 | 7 | 5.7 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2c(ncn2CC)n1 | 10.1016/j.bmcl.2006.10.091 | ||
11285792 | 866 | 30 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 696 | 17 | 1 | 7 | 8.7 | CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCCN2CC(C)C)C(=O)Nc1ccc(cc1)[S@@](=O)Cc1cncn1CCC | 10.1021/jm0509703 | ||
801 | 866 | 30 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 696 | 17 | 1 | 7 | 8.7 | CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCCN2CC(C)C)C(=O)Nc1ccc(cc1)[S@@](=O)Cc1cncn1CCC | 10.1021/jm0509703 | ||
CHEMBL2110727 | 866 | 30 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 696 | 17 | 1 | 7 | 8.7 | CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCCN2CC(C)C)C(=O)Nc1ccc(cc1)[S@@](=O)Cc1cncn1CCC | 10.1021/jm0509703 | ||
DB11758 | 866 | 30 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 696 | 17 | 1 | 7 | 8.7 | CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCCN2CC(C)C)C(=O)Nc1ccc(cc1)[S@@](=O)Cc1cncn1CCC | 10.1021/jm0509703 | ||
44288962 | 100008 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 572 | 10 | 2 | 5 | 4.5 | CN(C)CC(=O)NCCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL290845 | 100008 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 572 | 10 | 2 | 5 | 4.5 | CN(C)CC(=O)NCCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44288985 | 155002 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 668 | 14 | 2 | 9 | 3.5 | COc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c(OC)c1OC | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40427 | 155002 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 668 | 14 | 2 | 9 | 3.5 | COc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c(OC)c1OC | 10.1016/j.bmcl.2004.01.072 | ||
44288961 | 155091 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 3.8 | Cc1ccccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40468 | 155091 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 3.8 | Cc1ccccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
44289214 | 156761 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40771 | 156761 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288776 | 165766 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 571 | 10 | 2 | 8 | 3.3 | O=C(CN1C(=O)[C@@H](CC(=O)Nc2nccs2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42722 | 165766 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 571 | 10 | 2 | 8 | 3.3 | O=C(CN1C(=O)[C@@H](CC(=O)Nc2nccs2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
44288731 | 169771 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 588 | 11 | 2 | 6 | 3.9 | Cc1ccc([C@H]2S[C@H](CC(=O)NCc3cccc4ccccc34)C(=O)N2CC(=O)NCCCN2CCOCC2)c(C)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44472 | 169771 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 588 | 11 | 2 | 6 | 3.9 | Cc1ccc([C@H]2S[C@H](CC(=O)NCc3cccc4ccccc34)C(=O)N2CC(=O)NCCCN2CCOCC2)c(C)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44288963 | 170413 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 584 | 11 | 2 | 7 | 3.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccs1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44561 | 170413 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 584 | 11 | 2 | 7 | 3.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccs1 | 10.1016/j.bmcl.2004.01.072 | ||
45104751 | 199234 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 288 | 1 | 1 | 5 | 1.9 | Cc1cc(O)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
CHEMBL601651 | 199234 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 288 | 1 | 1 | 5 | 1.9 | Cc1cc(O)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
3793 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
134210626 | 176731 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 593 | 9 | 1 | 8 | 4.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(=O)(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4636749 | 176731 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 593 | 9 | 1 | 8 | 4.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(=O)(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
155557193 | 173953 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 538 | 5 | 1 | 7 | 6.0 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(C)(C)O | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4555534 | 173953 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 538 | 5 | 1 | 7 | 6.0 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(C)(C)O | 10.1021/acs.jmedchem.9b00506 | ||
44561588 | 192956 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL529664 | 192956 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44406247 | 140666 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 463 | 5 | 0 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3nccc(OCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL382826 | 140666 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 463 | 5 | 0 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3nccc(OCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
71454500 | 78582 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 409 | 11 | 1 | 4 | 5.9 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL2113068 | 78582 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 409 | 11 | 1 | 4 | 5.9 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)cc2Cl)c1 | 10.1016/j.bmcl.2005.02.084 | ||
44289275 | 101043 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL298035 | 101043 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
44289277 | 162951 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cc(Cl)ccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42021 | 162951 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cc(Cl)ccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289072 | 168774 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.3 | O=C(C[C@H]1S[C@H](c2cccc(C(F)(F)F)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44187 | 168774 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.3 | O=C(C[C@H]1S[C@H](c2cccc(C(F)(F)F)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44411038 | 76447 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.6 | Cc1cccc(Nc2cc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)no2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL206921 | 76447 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.6 | Cc1cccc(Nc2cc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)no2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
3793 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
44289062 | 163107 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(-c2ccccc2)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42044 | 163107 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(-c2ccccc2)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44289064 | 170364 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 660 | 12 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCCc1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44553 | 170364 | 0 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 660 | 12 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCCc1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
45104634 | 199052 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 304 | 2 | 2 | 6 | 1.7 | CCN1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
CHEMBL600196 | 199052 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 304 | 2 | 2 | 6 | 1.7 | CCN1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
45104523 | 200026 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 3 | 3 | 6 | 4.0 | Cc1c(N2CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL606421 | 200026 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 437 | 3 | 3 | 6 | 4.0 | Cc1c(N2CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
134225247 | 177089 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 545 | 7 | 1 | 8 | 4.6 | COC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641595 | 177089 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 545 | 7 | 1 | 8 | 4.6 | COC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
134210845 | 177475 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 565 | 8 | 1 | 8 | 3.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4647188 | 177475 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 565 | 8 | 1 | 8 | 3.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
155540774 | 171947 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 523 | 5 | 1 | 7 | 4.7 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(N)=O | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4483537 | 171947 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 523 | 5 | 1 | 7 | 4.7 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C(N)=O | 10.1021/acs.jmedchem.9b00506 | ||
44411321 | 137897 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 509 | 8 | 1 | 4 | 8.6 | FC(F)(F)c1ccccc1CN(Cc1csc(Nc2cccc3ccccc23)n1)CC1CCCCC1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL377421 | 137897 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 509 | 8 | 1 | 4 | 8.6 | FC(F)(F)c1ccccc1CN(Cc1csc(Nc2cccc3ccccc23)n1)CC1CCCCC1 | 10.1016/j.bmcl.2006.01.126 | ||
44430311 | 151848 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 11 | 2 | 6 | 5.9 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2cccnc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL397028 | 151848 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 11 | 2 | 6 | 5.9 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2cccnc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
44288958 | 168162 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43698 | 168162 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 624 | 11 | 2 | 5 | 5.6 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
44288981 | 165005 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 4.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCNCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42419 | 165005 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 4.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCNCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
25141301 | 185306 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL486840 | 185306 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.1 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3ccc(Cl)cc3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
156015374 | 177041 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 551 | 6 | 0 | 7 | 5.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4640909 | 177041 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 551 | 6 | 0 | 7 | 5.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(F)(F)F)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44411492 | 138367 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 283 | 2 | 1 | 4 | 4.7 | CC(C)(C)c1csc(Nc2cccc3cnccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL378272 | 138367 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 283 | 2 | 1 | 4 | 4.7 | CC(C)(C)c1csc(Nc2cccc3cnccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44288943 | 164077 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cc(Cl)cc(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42162 | 164077 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cc(Cl)cc(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44288913 | 168724 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 596 | 11 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44143 | 168724 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 596 | 11 | 2 | 6 | 3.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44401027 | 70208 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL194775 | 70208 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
134325041 | 174460 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 502 | 5 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4567398 | 174460 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 502 | 5 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
45104946 | 199036 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.3 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCCC3)ccc12 | 10.1021/jm901652p | ||
CHEMBL600018 | 199036 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.3 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCCC3)ccc12 | 10.1021/jm901652p | ||
45104635 | 199053 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 420 | 2 | 2 | 6 | 3.9 | Cc1c(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL600197 | 199053 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 420 | 2 | 2 | 6 | 3.9 | Cc1c(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
45104422 | 199547 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 406 | 3 | 2 | 6 | 2.9 | Cc1c(N2CCN(C(=O)/C=C/c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL603701 | 199547 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 406 | 3 | 2 | 6 | 2.9 | Cc1c(N2CCN(C(=O)/C=C/c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
45104527 | 199026 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 409 | 3 | 3 | 6 | 2.5 | Cc1c(N2CCN(C(=O)NCc3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL599996 | 199026 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 409 | 3 | 3 | 6 | 2.5 | Cc1c(N2CCN(C(=O)NCc3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
2812 | 4711 | 96 | None | - | 34 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | ||
CHEMBL104 | 4711 | 96 | None | - | 34 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | ||
71720517 | 86579 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
CHEMBL2324200 | 86579 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
45104848 | 199410 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 302 | 3 | 0 | 5 | 2.3 | CCOc1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
CHEMBL602887 | 199410 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 302 | 3 | 0 | 5 | 2.3 | CCOc1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
10417 | 1052 | 5 | None | - | 0 | Mouse | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
134324842 | 1052 | 5 | None | - | 0 | Mouse | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4459231 | 1052 | 5 | None | - | 0 | Mouse | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
9814022 | 76758 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 268 | 3 | 1 | 3 | 5.2 | CC(C)c1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207589 | 76758 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 268 | 3 | 1 | 3 | 5.2 | CC(C)c1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
692856 | 140831 | 16 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL383736 | 140831 | 16 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
71461653 | 78580 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 375 | 11 | 1 | 4 | 5.2 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccccc2Cl)c1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL2113066 | 78580 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 375 | 11 | 1 | 4 | 5.2 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccccc2Cl)c1 | 10.1016/j.bmcl.2005.02.084 | ||
134335393 | 169545 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 499 | 5 | 1 | 6 | 5.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(C3=CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4443688 | 169545 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 499 | 5 | 1 | 6 | 5.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(C3=CC[C@H](N4CCC[C@H]4CO)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
11496063 | 76766 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207642 | 76766 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
44288978 | 168171 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 585 | 10 | 1 | 5 | 5.9 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43706 | 168171 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 585 | 10 | 1 | 5 | 5.9 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288827 | 168236 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cccc(Cl)c2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43758 | 168236 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cccc(Cl)c2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
71458049 | 78589 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 359 | 11 | 1 | 4 | 4.7 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(F)cc2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL2113075 | 78589 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 359 | 11 | 1 | 4 | 4.7 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(F)cc2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
44561561 | 178423 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 439 | 6 | 1 | 7 | 4.5 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL470962 | 178423 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 439 | 6 | 1 | 7 | 4.5 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44288791 | 99733 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 558 | 12 | 2 | 6 | 3.3 | CC(C)CCNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL288256 | 99733 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 558 | 12 | 2 | 6 | 3.3 | CC(C)CCNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
44430309 | 86796 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 459 | 11 | 2 | 5 | 6.5 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2ccccc12 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232841 | 86796 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 459 | 11 | 2 | 5 | 6.5 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2ccccc12 | 10.1016/j.bmcl.2006.10.091 | ||
134325106 | 170685 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 4 | 0 | 6 | 6.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4460062 | 170685 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 500 | 4 | 0 | 6 | 6.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
45104945 | 199035 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 385 | 5 | 0 | 6 | 2.7 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCCCC3)ccc12 | 10.1021/jm901652p | ||
CHEMBL600017 | 199035 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 385 | 5 | 0 | 6 | 2.7 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCCCC3)ccc12 | 10.1021/jm901652p | ||
44430312 | 86832 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233046 | 86832 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
44288880 | 101088 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 626 | 11 | 2 | 5 | 5.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL298454 | 101088 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 626 | 11 | 2 | 5 | 5.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
3793 | 201519 | 70 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
44411325 | 168312 | 1 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 246 | 2 | 1 | 3 | 4.5 | Cc1cccc(Nc2nc(C(C)(C)C)cs2)c1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL438248 | 168312 | 1 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 246 | 2 | 1 | 3 | 4.5 | Cc1cccc(Nc2nc(C(C)(C)C)cs2)c1 | 10.1016/j.bmcl.2006.01.126 | ||
44288879 | 168777 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44188 | 168777 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44400833 | 70363 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 392 | 11 | 1 | 5 | 5.1 | CCN(CC)CCCC(C)Nc1nc(COc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195061 | 70363 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 392 | 11 | 1 | 5 | 5.1 | CCN(CC)CCCC(C)Nc1nc(COc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
44401066 | 125894 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 382 | 10 | 1 | 5 | 4.5 | CN(C)CCCCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL365155 | 125894 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 382 | 10 | 1 | 5 | 4.5 | CN(C)CCCCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44289208 | 163294 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 584 | 7 | 1 | 5 | 4.6 | CN1CCN(C(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42065 | 163294 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 584 | 7 | 1 | 5 | 4.6 | CN1CCN(C(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
71452724 | 78586 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 375 | 11 | 1 | 4 | 5.2 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL2113072 | 78586 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 375 | 11 | 1 | 4 | 5.2 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)cc2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
45104633 | 198717 | 18 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 290 | 1 | 2 | 6 | 1.3 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL598070 | 198717 | 18 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 290 | 1 | 2 | 6 | 1.3 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
9943773 | 76951 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 286 | 2 | 1 | 3 | 5.1 | CC(C)(C)c1csc(Nc2cccc3c2CCCC3)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL208249 | 76951 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 286 | 2 | 1 | 3 | 5.1 | CC(C)(C)c1csc(Nc2cccc3c2CCCC3)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44411033 | 76996 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 299 | 3 | 1 | 4 | 5.2 | CCn1ccc2c(Nc3nc(C(C)(C)C)cs3)cccc21 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL208458 | 76996 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 299 | 3 | 1 | 4 | 5.2 | CCn1ccc2c(Nc3nc(C(C)(C)C)cs3)cccc21 | 10.1016/j.bmcl.2006.01.126 | ||
44430302 | 86690 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 449 | 11 | 3 | 6 | 5.2 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2nc[nH]c12 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232639 | 86690 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 449 | 11 | 3 | 6 | 5.2 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2nc[nH]c12 | 10.1016/j.bmcl.2006.10.091 | ||
44289116 | 168714 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 572 | 11 | 2 | 6 | 3.7 | CC(C)(C)CCNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44134 | 168714 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 572 | 11 | 2 | 6 | 3.7 | CC(C)(C)CCNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
176 | 394 | 63 | None | -6 | 31 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
2157 | 394 | 63 | None | -6 | 31 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
2566 | 394 | 63 | None | -6 | 31 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
CHEMBL633 | 394 | 63 | None | -6 | 31 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
DB01118 | 394 | 63 | None | -6 | 31 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
134324891 | 173995 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 458 | 4 | 0 | 6 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4556507 | 173995 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 458 | 4 | 0 | 6 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
9922232 | 165206 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 296 | 3 | 1 | 3 | 5.6 | CC(C)(C)Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL424689 | 165206 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 296 | 3 | 1 | 3 | 5.6 | CC(C)(C)Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44289186 | 164530 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 3.8 | Cc1cccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42270 | 164530 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 3.8 | Cc1cccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c1 | 10.1016/j.bmcl.2004.01.072 | ||
44289105 | 97980 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 656 | 13 | 2 | 6 | 5.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL275593 | 97980 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 656 | 13 | 2 | 6 | 5.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288818 | 154873 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(CC1SC(c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40366 | 154873 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(CC1SC(c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44400899 | 70239 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 390 | 11 | 1 | 4 | 5.3 | CCN(CC)CCCC(C)Nc1nc(CCc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL194930 | 70239 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 390 | 11 | 1 | 4 | 5.3 | CCN(CC)CCCC(C)Nc1nc(CCc2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
44288912 | 165532 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 678 | 13 | 2 | 7 | 4.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCNS(=O)(=O)CCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42586 | 165532 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 678 | 13 | 2 | 7 | 4.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCNS(=O)(=O)CCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
134211126 | 176995 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 515 | 7 | 1 | 7 | 4.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(N)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4640439 | 176995 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 515 | 7 | 1 | 7 | 4.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(N)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
10308720 | 540 | 35 | None | - | 0 | Dog | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9678 | 540 | 35 | None | - | 0 | Dog | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4169247 | 540 | 35 | None | - | 0 | Dog | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 333 | 4 | 1 | 5 | 2.6 | COc1nccnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
44289241 | 99948 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 5.2 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL290201 | 99948 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 5.2 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288996 | 168794 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44198 | 168794 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
44289039 | 99779 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(-c2ccccc2)cc1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL288655 | 99779 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(-c2ccccc2)cc1 | 10.1016/j.bmcl.2004.01.072 | ||
44289340 | 100777 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 664 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(C(F)(F)F)c1F | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL296152 | 100777 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 664 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(C(F)(F)F)c1F | 10.1016/j.bmcl.2004.01.072 | ||
44288911 | 167361 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 595 | 11 | 2 | 7 | 3.1 | Cc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)n1C | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43143 | 167361 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 595 | 11 | 2 | 7 | 3.1 | Cc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)n1C | 10.1016/j.bmcl.2004.01.072 | ||
44400829 | 70973 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 412 | 9 | 1 | 4 | 6.4 | CCN(CC)CCCC(C)Nc1nc(-c2ccc3ccccc3c2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195751 | 70973 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 412 | 9 | 1 | 4 | 6.4 | CCN(CC)CCCC(C)Nc1nc(-c2ccc3ccccc3c2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
44400922 | 68308 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 11 | 1 | 5 | 4.6 | CCN(CC)CCCC(C)Nc1ccnc(COc2cccc(Cl)c2)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL191915 | 68308 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 376 | 11 | 1 | 5 | 4.6 | CCN(CC)CCCC(C)Nc1ccnc(COc2cccc(Cl)c2)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44400881 | 71061 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1ccnc(COc2cc(Cl)cc(Cl)c2)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195893 | 71061 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1ccnc(COc2cc(Cl)cc(Cl)c2)n1 | 10.1016/j.bmcl.2005.02.084 | ||
45104427 | 199165 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 473 | 4 | 3 | 8 | 2.0 | CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3c(C)c4c(O)cc(O)cc4oc3=O)CC2)cc1 | 10.1021/jm901652p | ||
CHEMBL601217 | 199165 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 473 | 4 | 3 | 8 | 2.0 | CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3c(C)c4c(O)cc(O)cc4oc3=O)CC2)cc1 | 10.1021/jm901652p | ||
134325076 | 171619 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 579 | 7 | 1 | 8 | 4.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(N)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4473604 | 171619 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 579 | 7 | 1 | 8 | 4.4 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCS(N)(=O)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134211098 | 177470 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 8 | 0 | 8 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4647117 | 177470 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 564 | 8 | 0 | 8 | 4.6 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
9856506 | 76405 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 260 | 2 | 1 | 3 | 4.8 | Cc1cccc(Nc2nc(C(C)(C)C)cs2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL206789 | 76405 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 260 | 2 | 1 | 3 | 4.8 | Cc1cccc(Nc2nc(C(C)(C)C)cs2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
44430305 | 86693 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 12 | 2 | 7 | 5.7 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2ncn(CC)c12 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232641 | 86693 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 477 | 12 | 2 | 7 | 5.7 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)nc2ncn(CC)c12 | 10.1016/j.bmcl.2006.10.091 | ||
11223594 | 70740 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195298 | 70740 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44430315 | 11761 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL1182360 | 11761 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233047 | 11761 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 409 | 11 | 2 | 5 | 5.3 | CCN(CC)C(C)CCCNc1nccc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
44430308 | 151593 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 433 | 10 | 1 | 5 | 5.7 | CCN(CC)CCCC(C)Nc1ccc2cnn(Cc3ccc(Cl)cc3Cl)c2n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL396787 | 151593 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 433 | 10 | 1 | 5 | 5.7 | CCN(CC)CCCC(C)Nc1ccc2cnn(Cc3ccc(Cl)cc3Cl)c2n1 | 10.1016/j.bmcl.2006.10.091 | ||
44401007 | 70496 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1ccnc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195103 | 70496 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 410 | 11 | 1 | 5 | 5.3 | CCN(CC)CCCC(C)Nc1ccnc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44289401 | 162893 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 604 | 10 | 2 | 6 | 4.0 | O=C(CN1C(=O)[C@@H](CC(=O)N[C@@H]2CCc3ccccc32)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL41983 | 162893 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 604 | 10 | 2 | 6 | 4.0 | O=C(CN1C(=O)[C@@H](CC(=O)N[C@@H]2CCc3ccccc32)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
44289082 | 166019 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 550 | 11 | 2 | 7 | 2.9 | O=C(C[C@H]1S[C@H](c2ccco2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42799 | 166019 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 550 | 11 | 2 | 7 | 2.9 | O=C(C[C@H]1S[C@H](c2ccco2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
23585443 | 537 | 7 | None | - | 0 | Dog | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9679 | 537 | 7 | None | - | 0 | Dog | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
CHEMBL4172635 | 537 | 7 | None | - | 0 | Dog | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 351 | 4 | 1 | 5 | 2.7 | COc1nc(F)cnc1NS(=O)(=O)c1cccc(c1Cl)Cl | 10.1021/acsmedchemlett.7b00315 | ||
9900444 | 76808 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 283 | 2 | 1 | 4 | 4.7 | CC(C)(C)c1csc(Nc2cccc3ncccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207857 | 76808 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 283 | 2 | 1 | 4 | 4.7 | CC(C)(C)c1csc(Nc2cccc3ncccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44406309 | 133013 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 5 | 1 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3ccnc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL370861 | 133013 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 5 | 1 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3ccnc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
692856 | 140831 | 16 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL383736 | 140831 | 16 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 240 | 2 | 1 | 3 | 4.3 | Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44288879 | 168777 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44188 | 168777 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44400947 | 70978 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 396 | 11 | 1 | 5 | 4.9 | CCN(CC)CCCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195764 | 70978 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 396 | 11 | 1 | 5 | 4.9 | CCN(CC)CCCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
11496063 | 76766 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207642 | 76766 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 447 | 8 | 1 | 4 | 8.0 | c1ccc2c(Nc3nc(CN(CC4CCCCC4)CC4CCCCC4)cs3)cccc2c1 | 10.1016/j.bmcl.2006.01.126 | ||
44288903 | 165828 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 612 | 11 | 2 | 5 | 5.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42757 | 165828 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 612 | 11 | 2 | 5 | 5.4 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
45104849 | 200836 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 384 | 4 | 0 | 5 | 4.2 | CCC1CCC(Oc2ccc3c(C)c(N4CCN(C)CC4)c(=O)oc3c2)CC1 | 10.1021/jm901652p | ||
CHEMBL611508 | 200836 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 384 | 4 | 0 | 5 | 4.2 | CCC1CCC(Oc2ccc3c(C)c(N4CCN(C)CC4)c(=O)oc3c2)CC1 | 10.1021/jm901652p | ||
45104748 | 199352 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 380 | 2 | 2 | 6 | 3.5 | Cc1cccc(N2CCN(c3c(C)c4c(O)cc(O)cc4oc3=O)CC2)c1C | 10.1021/jm901652p | ||
CHEMBL602474 | 199352 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 380 | 2 | 2 | 6 | 3.5 | Cc1cccc(N2CCN(c3c(C)c4c(O)cc(O)cc4oc3=O)CC2)c1C | 10.1021/jm901652p | ||
44289098 | 100916 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 638 | 13 | 2 | 8 | 3.5 | COc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c(OC)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL297173 | 100916 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 638 | 13 | 2 | 8 | 3.5 | COc1ccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c(OC)c1 | 10.1016/j.bmcl.2004.01.072 | ||
134335394 | 171776 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4475665 | 171776 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
134225255 | 176751 | 4 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637143 | 176751 | 4 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44289027 | 100762 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 652 | 8 | 1 | 5 | 6.3 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCC(N3CCCCC3)CC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL296067 | 100762 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 652 | 8 | 1 | 5 | 6.3 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCC(N3CCCCC3)CC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288779 | 100943 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 571 | 9 | 1 | 5 | 5.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL297335 | 100943 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 571 | 9 | 1 | 5 | 5.5 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289036 | 162556 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 566 | 11 | 2 | 7 | 3.4 | O=C(C[C@H]1S[C@H](c2cccs2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL417712 | 162556 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 566 | 11 | 2 | 7 | 3.4 | O=C(C[C@H]1S[C@H](c2cccs2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289106 | 164974 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 620 | 13 | 2 | 8 | 3.3 | COc1ccc([C@H]2S[C@H](CC(=O)NCc3cccc4ccccc34)C(=O)N2CC(=O)NCCCN2CCOCC2)c(OC)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42411 | 164974 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 620 | 13 | 2 | 8 | 3.3 | COc1ccc([C@H]2S[C@H](CC(=O)NCc3cccc4ccccc34)C(=O)N2CC(=O)NCCCN2CCOCC2)c(OC)c1 | 10.1016/j.bmcl.2004.01.072 | ||
21866580 | 76793 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 481 | 8 | 1 | 3 | 8.0 | Cc1cccc(Nc2cccc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)n2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207780 | 76793 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 481 | 8 | 1 | 3 | 8.0 | Cc1cccc(Nc2cccc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)n2)c1C | 10.1016/j.bmcl.2006.01.126 | ||
44289276 | 167363 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 634 | 11 | 2 | 7 | 4.7 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1csc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43144 | 167363 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 634 | 11 | 2 | 7 | 4.7 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1csc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288726 | 168872 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 561 | 11 | 2 | 7 | 2.7 | O=C(C[C@H]1S[C@H](c2ccncc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44262 | 168872 | 0 | None | - | 0 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 561 | 11 | 2 | 7 | 2.7 | O=C(C[C@H]1S[C@H](c2ccncc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
71720517 | 86579 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
CHEMBL2324200 | 86579 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
44289235 | 100910 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 584 | 8 | 2 | 5 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCC(=O)N2CCNCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL297145 | 100910 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 584 | 8 | 2 | 5 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCC(=O)N2CCNCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289204 | 169282 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 10 | 2 | 6 | 4.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44401 | 169282 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 614 | 10 | 2 | 6 | 4.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
134325003 | 174810 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 543 | 7 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4575089 | 174810 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 543 | 7 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC(N)=O)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
134225259 | 177170 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 517 | 7 | 2 | 8 | 3.0 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(N)=O)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4642563 | 177170 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 517 | 7 | 2 | 8 | 3.0 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(N)=O)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44288904 | 164116 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 5 | 4.9 | CN(C)CCCNC(=O)CN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42168 | 164116 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 586 | 11 | 2 | 5 | 4.9 | CN(C)CCCNC(=O)CN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44289227 | 168868 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 600 | 11 | 1 | 5 | 5.2 | CN(C)CCCN(C)C(=O)CN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44259 | 168868 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 600 | 11 | 1 | 5 | 5.2 | CN(C)CCCN(C)C(=O)CN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44430317 | 86914 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 439 | 12 | 3 | 7 | 4.8 | CCN(CC)CCCC(C)Nc1nc(NC)nc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233261 | 86914 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 439 | 12 | 3 | 7 | 4.8 | CCN(CC)CCCC(C)Nc1nc(NC)nc(NCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
44288898 | 168123 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 515 | 8 | 1 | 4 | 5.4 | CN(C)CCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43661 | 168123 | 0 | None | - | 0 | Human | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 515 | 8 | 1 | 4 | 5.4 | CN(C)CCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
155531126 | 171041 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4465359 | 171041 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCCCC4)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
21866577 | 75612 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 285 | 2 | 1 | 4 | 4.7 | Cn1ccc2c(Nc3nc(C(C)(C)C)cs3)cccc21 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL205279 | 75612 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 285 | 2 | 1 | 4 | 4.7 | Cn1ccc2c(Nc3nc(C(C)(C)C)cs3)cccc21 | 10.1016/j.bmcl.2006.01.126 | ||
134210898 | 177209 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 516 | 7 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643158 | 177209 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 516 | 7 | 1 | 7 | 4.7 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44411191 | 139709 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 484 | 8 | 1 | 4 | 7.4 | Cc1cccc(Nc2cc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)nn2C)c1C | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL380537 | 139709 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 484 | 8 | 1 | 4 | 7.4 | Cc1cccc(Nc2cc(CN(Cc3ccccc3C(F)(F)F)CC3CCCCC3)nn2C)c1C | 10.1016/j.bmcl.2006.01.126 | ||
156012782 | 176790 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 545 | 7 | 1 | 8 | 3.6 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(=O)N(C)C)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637695 | 176790 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 545 | 7 | 1 | 8 | 3.6 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C(=O)N(C)C)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44289203 | 169966 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 642 | 12 | 2 | 6 | 5.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44498 | 169966 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 642 | 12 | 2 | 6 | 5.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
134324973 | 169819 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4447900 | 169819 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 486 | 4 | 0 | 6 | 5.8 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4C)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
45104844 | 199236 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 304 | 2 | 1 | 6 | 1.6 | COc1cc(O)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
CHEMBL601653 | 199236 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 304 | 2 | 1 | 6 | 1.6 | COc1cc(O)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
134225255 | 176751 | 4 | None | - | 0 | Mouse | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637143 | 176751 | 4 | None | - | 0 | Mouse | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
71720517 | 86579 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
CHEMBL2324200 | 86579 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
134211057 | 177051 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 529 | 7 | 1 | 7 | 4.3 | CC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4641127 | 177051 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 529 | 7 | 1 | 7 | 4.3 | CC(=O)NCCN1CCC[C@H](C2CN(c3cnc4c(C)nn([C@H](C)c5ccc(Cl)cc5Cl)c4n3)C2)C1 | 10.1021/acs.jmedchem.0c00988 | ||
44289341 | 162921 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 11 | 2 | 6 | 4.4 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42001 | 162921 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 626 | 11 | 2 | 6 | 4.4 | Cc1c(Cl)cccc1CNC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O | 10.1016/j.bmcl.2004.01.072 | ||
44288923 | 163116 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cc(Cl)ccc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42046 | 163116 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cc(Cl)ccc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44288683 | 168504 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 578 | 11 | 2 | 6 | 3.5 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43969 | 168504 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 578 | 11 | 2 | 6 | 3.5 | O=C(C[C@H]1S[C@H](c2ccc(F)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
71449124 | 78583 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 409 | 11 | 1 | 4 | 5.9 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)c(Cl)c2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL2113069 | 78583 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 409 | 11 | 1 | 4 | 5.9 | CCN(CC)CCCC(C)Nc1ccnc(COc2ccc(Cl)c(Cl)c2)c1 | 10.1016/j.bmcl.2005.02.084 | ||
134336138 | 176921 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 527 | 7 | 1 | 8 | 4.2 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4639418 | 176921 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 527 | 7 | 1 | 8 | 4.2 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
45104752 | 199898 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 302 | 1 | 0 | 6 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc3c(cc12)OCO3 | 10.1021/jm901652p | ||
CHEMBL605581 | 199898 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 302 | 1 | 0 | 6 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc3c(cc12)OCO3 | 10.1021/jm901652p | ||
45104423 | 199235 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 330 | 2 | 2 | 6 | 1.3 | C=CC(=O)N1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
CHEMBL601652 | 199235 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 330 | 2 | 2 | 6 | 1.3 | C=CC(=O)N1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
45104321 | 199037 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 276 | 1 | 3 | 6 | 0.9 | Cc1c(N2CCNCC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL600019 | 199037 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 276 | 1 | 3 | 6 | 0.9 | Cc1c(N2CCNCC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
45104425 | 199195 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 380 | 2 | 2 | 6 | 2.5 | Cc1c(N2CCN(C(=O)c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL601424 | 199195 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 380 | 2 | 2 | 6 | 2.5 | Cc1c(N2CCN(C(=O)c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
134335394 | 171776 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4475665 | 171776 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 494 | 4 | 0 | 6 | 6.3 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1C | 10.1021/acs.jmedchem.9b00506 | ||
44411266 | 76404 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 274 | 3 | 1 | 3 | 5.3 | CC(C)c1ccccc1Nc1nc(C(C)(C)C)cs1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL206788 | 76404 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 274 | 3 | 1 | 3 | 5.3 | CC(C)c1ccccc1Nc1nc(C(C)(C)C)cs1 | 10.1016/j.bmcl.2006.01.126 | ||
44289342 | 165559 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 606 | 11 | 2 | 6 | 4.1 | Cc1cccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c1C | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42600 | 165559 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 606 | 11 | 2 | 6 | 4.1 | Cc1cccc(CNC(=O)C[C@H]2S[C@H](c3ccc(Cl)cc3Cl)N(CC(=O)NCCCN3CCOCC3)C2=O)c1C | 10.1016/j.bmcl.2004.01.072 | ||
156010350 | 176508 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 531 | 7 | 2 | 8 | 3.2 | CNC(=O)c1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633133 | 176508 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 531 | 7 | 2 | 8 | 3.2 | CNC(=O)c1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
10133595 | 76715 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 367 | 8 | 1 | 4 | 6.2 | CC(C)CN(Cc1csc(Nc2cccc3ccccc23)n1)CC(C)C | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207320 | 76715 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 367 | 8 | 1 | 4 | 6.2 | CC(C)CN(Cc1csc(Nc2cccc3ccccc23)n1)CC(C)C | 10.1016/j.bmcl.2006.01.126 | ||
9899450 | 76186 | 2 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 232 | 2 | 1 | 3 | 4.2 | CC(C)(C)c1csc(Nc2ccccc2)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL206103 | 76186 | 2 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 232 | 2 | 1 | 3 | 4.2 | CC(C)(C)c1csc(Nc2ccccc2)n1 | 10.1016/j.bmcl.2006.01.126 | ||
45104846 | 199078 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 301 | 2 | 0 | 5 | 1.9 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(N(C)C)ccc12 | 10.1021/jm901652p | ||
CHEMBL600409 | 199078 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 301 | 2 | 0 | 5 | 1.9 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(N(C)C)ccc12 | 10.1021/jm901652p | ||
45104845 | 197495 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 318 | 3 | 0 | 6 | 1.9 | COc1cc(OC)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
CHEMBL589521 | 197495 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 318 | 3 | 0 | 6 | 1.9 | COc1cc(OC)c2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
21866574 | 76737 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 271 | 2 | 2 | 3 | 4.7 | CC(C)(C)c1csc(Nc2cccc3[nH]ccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL207479 | 76737 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 271 | 2 | 2 | 3 | 4.7 | CC(C)(C)c1csc(Nc2cccc3[nH]ccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44430303 | 86692 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 449 | 11 | 3 | 6 | 5.2 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2[nH]cnc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232640 | 86692 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 449 | 11 | 3 | 6 | 5.2 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2[nH]cnc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
134225255 | 176751 | 4 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637143 | 176751 | 4 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
44430310 | 86831 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 459 | 11 | 2 | 5 | 6.5 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2ccccc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL233045 | 86831 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 459 | 11 | 2 | 5 | 6.5 | CCN(CC)CCCC(C)Nc1nc(NCc2ccc(Cl)cc2Cl)c2ccccc2n1 | 10.1016/j.bmcl.2006.10.091 | ||
3793 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
3793 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
44562156 | 186147 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3cccc(Br)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL488704 | 186147 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 511 | 6 | 1 | 7 | 5.2 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(Nc3cccc(Br)c3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
45104847 | 198752 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 288 | 2 | 0 | 5 | 1.9 | COc1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
CHEMBL598339 | 198752 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 288 | 2 | 0 | 5 | 1.9 | COc1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 | 10.1021/jm901652p | ||
156010372 | 176534 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 508 | 6 | 0 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633494 | 176534 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 508 | 6 | 0 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCC#N)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
45104943 | 199439 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 384 | 5 | 0 | 6 | 3.5 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCc3cccs3)ccc12 | 10.1021/jm901652p | ||
CHEMBL603104 | 199439 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 384 | 5 | 0 | 6 | 3.5 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCc3cccs3)ccc12 | 10.1021/jm901652p | ||
45104524 | 199124 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 417 | 7 | 3 | 6 | 3.3 | CCCCCCCNC(=O)N1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
CHEMBL600805 | 199124 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 417 | 7 | 3 | 6 | 3.3 | CCCCCCCNC(=O)N1CCN(c2c(C)c3c(O)cc(O)cc3oc2=O)CC1 | 10.1021/jm901652p | ||
4015979 | 76994 | 2 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 302 | 3 | 1 | 3 | 5.7 | c1ccc(-c2csc(Nc3cccc4ccccc34)n2)cc1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL208452 | 76994 | 2 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 302 | 3 | 1 | 3 | 5.7 | c1ccc(-c2csc(Nc3cccc4ccccc34)n2)cc1 | 10.1016/j.bmcl.2006.01.126 | ||
134210768 | 176880 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 530 | 8 | 1 | 7 | 5.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4638846 | 176880 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 530 | 8 | 1 | 7 | 5.1 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCCC(=O)O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44406246 | 72680 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 479 | 9 | 2 | 6 | 4.3 | CC(C)[C@@H](CNc1nccc(OCc2ccc(Cl)cc2Cl)n1)NC(=O)C1CCCN(C)C1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL200966 | 72680 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 479 | 9 | 2 | 6 | 4.3 | CC(C)[C@@H](CNc1nccc(OCc2ccc(Cl)cc2Cl)n1)NC(=O)C1CCCN(C)C1 | 10.1016/j.bmcl.2005.09.022 | ||
44288897 | 101016 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 529 | 9 | 1 | 4 | 5.7 | CN(C)CCCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL297854 | 101016 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 529 | 9 | 1 | 4 | 5.7 | CN(C)CCCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44288663 | 99796 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 641 | 11 | 2 | 6 | 4.5 | CN1CCN(CCCNC(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL288800 | 99796 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 641 | 11 | 2 | 6 | 4.5 | CN1CCN(CCCNC(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
156010600 | 176564 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 550 | 7 | 0 | 8 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4633920 | 176564 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 550 | 7 | 0 | 8 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(C)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
134325016 | 174081 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 513 | 5 | 1 | 8 | 4.3 | C[C@@H]1CN(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)CC[C@@H]1N1CCC[C@H]1CO | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4558456 | 174081 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 513 | 5 | 1 | 8 | 4.3 | C[C@@H]1CN(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)CC[C@@H]1N1CCC[C@H]1CO | 10.1021/acs.jmedchem.9b00506 | ||
45104747 | 199330 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 370 | 2 | 2 | 6 | 3.0 | Cc1c(N2CCN(c3ccc(F)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL602269 | 199330 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 370 | 2 | 2 | 6 | 3.0 | Cc1c(N2CCN(c3ccc(F)cc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
134211225 | 177351 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 557 | 8 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNC(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4645325 | 177351 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 557 | 8 | 1 | 7 | 5.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCNC(=O)C(C)C)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
44406338 | 72577 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 434 | 5 | 2 | 6 | 2.8 | O=C([C@H]1CCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL200465 | 72577 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 434 | 5 | 2 | 6 | 2.8 | O=C([C@H]1CCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
44288972 | 165879 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 638 | 8 | 1 | 5 | 5.9 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCC(N3CCCC3)CC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42774 | 165879 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 638 | 8 | 1 | 5 | 5.9 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)N2CCC(N3CCCC3)CC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
45104525 | 199657 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 487 | 4 | 3 | 7 | 4.7 | Cc1c(N2CCN(C(=O)Nc3ccccc3Oc3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL604330 | 199657 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 487 | 4 | 3 | 7 | 4.7 | Cc1c(N2CCN(C(=O)Nc3ccccc3Oc3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
44289283 | 100784 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(CN1C(=O)[C@@H](CC(=O)NC(c2ccccc2)c2ccccc2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL296192 | 100784 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(CN1C(=O)[C@@H](CC(=O)NC(c2ccccc2)c2ccccc2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
44289063 | 161422 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL415902 | 161422 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 654 | 12 | 2 | 6 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
44289097 | 178049 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 680 | 11 | 2 | 6 | 5.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)c(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL46748 | 178049 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 680 | 11 | 2 | 6 | 5.2 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccc(Cl)c(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.01.072 | ||
45104426 | 200169 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 416 | 3 | 2 | 7 | 2.0 | Cc1c(N2CCN(S(=O)(=O)c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL607137 | 200169 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 416 | 3 | 2 | 7 | 2.0 | Cc1c(N2CCN(S(=O)(=O)c3ccccc3)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
44401118 | 70726 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 388 | 10 | 1 | 4 | 5.7 | CCN(CC)CCCC(C)Nc1nc(/C=C/c2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195203 | 70726 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 388 | 10 | 1 | 4 | 5.7 | CCN(CC)CCCC(C)Nc1nc(/C=C/c2ccccc2)nc2ccccc12 | 10.1016/j.bmcl.2005.02.084 | ||
134324770 | 170376 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 509 | 5 | 1 | 7 | 5.2 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1CN | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4455432 | 170376 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 509 | 5 | 1 | 7 | 5.2 | C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CC[C@@H]1N1CCC[C@H]1CN | 10.1021/acs.jmedchem.9b00506 | ||
134225255 | 176751 | 4 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4637143 | 176751 | 4 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 499 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CCO)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
44561217 | 188527 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCN(C(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL510375 | 188527 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCN(C(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44289057 | 164790 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 566 | 11 | 2 | 7 | 3.4 | O=C(C[C@H]1S[C@H](c2ccsc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42360 | 164790 | 0 | None | - | 0 | Human | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 566 | 11 | 2 | 7 | 3.4 | O=C(C[C@H]1S[C@H](c2ccsc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289281 | 100634 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 618 | 10 | 2 | 6 | 4.4 | O=C(CN1C(=O)[C@@H](CC(=O)NC2CCCc3ccccc32)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL295057 | 100634 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 618 | 10 | 2 | 6 | 4.4 | O=C(CN1C(=O)[C@@H](CC(=O)NC2CCCc3ccccc32)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
45104944 | 199034 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 387 | 5 | 0 | 7 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCOCC3)ccc12 | 10.1021/jm901652p | ||
CHEMBL600016 | 199034 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 387 | 5 | 0 | 7 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(OCCN3CCOCC3)ccc12 | 10.1021/jm901652p | ||
44288799 | 101062 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL298230 | 101062 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
10417 | 1052 | 5 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
134324842 | 1052 | 5 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4459231 | 1052 | 5 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 510 | 5 | 1 | 7 | 5.3 | OC[C@@H]1CCCN1[C@H]1CC=C(C[C@H]1C)c1cnc2c(n1)n(nc2C#N)[C@@H](c1ccc(cc1Cl)Cl)C | 10.1021/acs.jmedchem.9b00506 | ||
16724339 | 185855 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
CHEMBL487635 | 185855 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.07.062 | ||
16724339 | 185855 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL487635 | 185855 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 453 | 6 | 1 | 7 | 4.8 | COc1cc2nc(N3CCC(N4CCCC4)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
44406282 | 72359 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 462 | 5 | 1 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL199733 | 72359 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 462 | 5 | 1 | 6 | 3.4 | CN1CCCC(C(=O)N2CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.bmcl.2005.09.022 | ||
44289055 | 99896 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 568 | 11 | 2 | 7 | 3.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccco1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL289661 | 99896 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 568 | 11 | 2 | 7 | 3.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1ccco1 | 10.1016/j.bmcl.2004.01.072 | ||
44288575 | 154643 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 570 | 10 | 2 | 6 | 3.6 | O=C(CN1C(=O)[C@@H](CC(=O)NC2CCCCC2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40238 | 154643 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 570 | 10 | 2 | 6 | 3.6 | O=C(CN1C(=O)[C@@H](CC(=O)NC2CCCCC2)S[C@@H]1c1ccc(Cl)cc1Cl)NCCCN1CCOCC1 | 10.1016/j.bmcl.2004.01.072 | ||
44288698 | 168527 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2cccc(Cl)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43988 | 168527 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2cccc(Cl)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
134210954 | 177236 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4643609 | 177236 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 551 | 7 | 1 | 8 | 3.5 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCS(N)(=O)=O)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
3793 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
25141190 | 1124 | 24 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
9478 | 1124 | 24 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL508207 | 1124 | 24 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 467 | 6 | 1 | 7 | 5.2 | COc1cc2c(NC3CCCCCC3)nc(nc2cc1OC)N1CCC(CC1)N1CCCCC1 | 10.1016/j.bmc.2008.05.036 | ||
44561137 | 186137 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCC(N(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
CHEMBL488640 | 186137 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 427 | 6 | 1 | 7 | 4.3 | COc1cc2nc(N3CCC(N(C)C)CC3)nc(NC3CCCCCC3)c2cc1OC | 10.1016/j.bmc.2008.05.036 | ||
45104850 | 199411 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 394 | 5 | 0 | 6 | 3.4 | COc1ccc(COc2ccc3c(C)c(N4CCN(C)CC4)c(=O)oc3c2)cc1 | 10.1021/jm901652p | ||
CHEMBL602888 | 199411 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 394 | 5 | 0 | 6 | 3.4 | COc1ccc(COc2ccc3c(C)c(N4CCN(C)CC4)c(=O)oc3c2)cc1 | 10.1021/jm901652p | ||
134211185 | 176579 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 488 | 6 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4634054 | 176579 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 488 | 6 | 1 | 7 | 4.2 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC([C@H]4CCCN(CCO)C4)C3)cnc12 | 10.1021/acs.jmedchem.0c00988 | ||
156018849 | 177333 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4645037 | 177333 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 513 | 6 | 1 | 8 | 3.8 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(CC(=O)O)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
45104750 | 199233 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 274 | 1 | 1 | 5 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(O)ccc12 | 10.1021/jm901652p | ||
CHEMBL601650 | 199233 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 274 | 1 | 1 | 5 | 1.6 | Cc1c(N2CCN(C)CC2)c(=O)oc2cc(O)ccc12 | 10.1021/jm901652p | ||
44289343 | 165308 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(Cl)c1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42491 | 165308 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 646 | 11 | 2 | 6 | 4.8 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(Cl)c1Cl | 10.1016/j.bmcl.2004.01.072 | ||
3793 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
45039617 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
CHEMBL64391 | 201519 | 70 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | ||
44430313 | 149269 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 5 | 2 | 7 | 3.3 | O=C([C@@H]1CCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL394859 | 149269 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 485 | 5 | 2 | 7 | 3.3 | O=C([C@@H]1CCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2006.10.091 | ||
44411037 | 76430 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 266 | 2 | 1 | 3 | 4.9 | CC(C)(C)c1coc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL206878 | 76430 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 266 | 2 | 1 | 3 | 4.9 | CC(C)(C)c1coc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
9814340 | 138979 | 1 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 282 | 2 | 1 | 3 | 5.3 | CC(C)(C)c1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL379460 | 138979 | 1 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 282 | 2 | 1 | 3 | 5.3 | CC(C)(C)c1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44410966 | 168476 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 6 | 1 | 4 | 4.9 | CCN(CC)Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL439518 | 168476 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 6 | 1 | 4 | 4.9 | CCN(CC)Cc1csc(Nc2cccc3ccccc23)n1 | 10.1016/j.bmcl.2006.01.126 | ||
44406355 | 72419 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.0 | O=C(C1CCCNC1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
CHEMBL199913 | 72419 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.0 | O=C(C1CCCNC1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.bmcl.2005.09.022 | ||
44288828 | 99992 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2c(Cl)cccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL290678 | 99992 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2c(Cl)cccc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289242 | 154896 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 5.2 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40377 | 154896 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 642 | 11 | 2 | 6 | 5.2 | C[C@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44289205 | 162620 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 598 | 8 | 2 | 5 | 5.0 | CN1CCC(NC(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL418072 | 162620 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 598 | 8 | 2 | 5 | 5.0 | CN1CCC(NC(=O)CN2C(=O)[C@@H](CC(=O)NCc3cccc4ccccc34)S[C@@H]2c2ccc(Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2004.01.072 | ||
44288996 | 168794 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL44198 | 168794 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 592 | 11 | 2 | 6 | 4.0 | C[C@@H](NC(=O)C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)c1ccccc1 | 10.1016/j.bmcl.2004.01.072 | ||
44401087 | 70782 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 382 | 10 | 1 | 5 | 4.5 | CCN(CC)CCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL195484 | 70782 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 382 | 10 | 1 | 5 | 4.5 | CCN(CC)CCCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44430306 | 86794 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 10 | 1 | 6 | 5.1 | CCN(CC)CCCC(C)Nc1ncc2ncn(Cc3ccc(Cl)cc3Cl)c2n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232839 | 86794 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 10 | 1 | 6 | 5.1 | CCN(CC)CCCC(C)Nc1ncc2ncn(Cc3ccc(Cl)cc3Cl)c2n1 | 10.1016/j.bmcl.2006.10.091 | ||
44430307 | 86795 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 10 | 1 | 6 | 5.1 | CCN(CC)CCCC(C)Nc1ncc2c(ncn2Cc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
CHEMBL232840 | 86795 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 434 | 10 | 1 | 6 | 5.1 | CCN(CC)CCCC(C)Nc1ncc2c(ncn2Cc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2006.10.091 | ||
44288818 | 154873 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(CC1SC(c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL40366 | 154873 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(CC1SC(c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288682 | 165531 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42585 | 165531 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 594 | 11 | 2 | 6 | 4.0 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
3117 | 206106 | 100 | None | -4 | 16 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | nan | ||
CHEMBL964 | 206106 | 100 | None | -4 | 16 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | nan | ||
45104424 | 199622 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 352 | 2 | 2 | 6 | 1.4 | Cc1c(N2CCN(C(=O)CCl)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
CHEMBL604130 | 199622 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 352 | 2 | 2 | 6 | 1.4 | Cc1c(N2CCN(C(=O)CCl)CC2)c(=O)oc2cc(O)cc(O)c12 | 10.1021/jm901652p | ||
155541406 | 172426 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 525 | 6 | 0 | 7 | 6.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC#N)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
CHEMBL4518040 | 172426 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 525 | 6 | 0 | 7 | 6.0 | Cc1nn([C@H](C)c2ccc(Cl)cc2Cl)c2nc(N3CC[C@H](N4CCC[C@H]4CCC#N)[C@H](C)C3)cnc12 | 10.1021/acs.jmedchem.9b00506 | ||
5071677 | 75647 | 16 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 358 | 3 | 1 | 3 | 7.0 | CC(C)(C)c1ccc(-c2csc(Nc3cccc4ccccc34)n2)cc1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL205490 | 75647 | 16 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 358 | 3 | 1 | 3 | 7.0 | CC(C)(C)c1ccc(-c2csc(Nc3cccc4ccccc34)n2)cc1 | 10.1016/j.bmcl.2006.01.126 | ||
44411322 | 140384 | 1 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 246 | 2 | 1 | 3 | 4.5 | Cc1ccccc1Nc1nc(C(C)(C)C)cs1 | 10.1016/j.bmcl.2006.01.126 | ||
CHEMBL382244 | 140384 | 1 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 246 | 2 | 1 | 3 | 4.5 | Cc1ccccc1Nc1nc(C(C)(C)C)cs1 | 10.1016/j.bmcl.2006.01.126 | ||
44288481 | 100682 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 557 | 8 | 1 | 5 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL295405 | 100682 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 557 | 8 | 1 | 5 | 5.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44288998 | 165947 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 558 | 10 | 3 | 5 | 4.3 | NCCNC(=O)CCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42786 | 165947 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 558 | 10 | 3 | 5 | 4.3 | NCCNC(=O)CCN1C(=O)[C@@H](CC(=O)NCc2cccc3ccccc23)S[C@@H]1c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.01.072 | ||
44289278 | 167287 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cc(Cl)cc(Cl)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL43092 | 167287 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 628 | 11 | 2 | 6 | 4.6 | O=C(C[C@H]1S[C@H](c2cc(Cl)cc(Cl)c2)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc2ccccc12 | 10.1016/j.bmcl.2004.01.072 | ||
44401153 | 134759 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 368 | 9 | 1 | 5 | 4.1 | CCN(CC)CCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
CHEMBL372670 | 134759 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 368 | 9 | 1 | 5 | 4.1 | CCN(CC)CCNc1nccc(OCc2ccc(Cl)cc2Cl)n1 | 10.1016/j.bmcl.2005.02.084 | ||
44288964 | 164352 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
CHEMBL42226 | 164352 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 612 | 11 | 2 | 6 | 4.1 | O=C(C[C@H]1S[C@H](c2ccc(Cl)cc2Cl)N(CC(=O)NCCCN2CCOCC2)C1=O)NCc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.01.072 | ||
134210933 | 176932 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 535 | 6 | 1 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(Cc5cnc[nH]5)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
CHEMBL4639600 | 176932 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 535 | 6 | 1 | 8 | 4.7 | C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(N3CC([C@H]4CCCN(Cc5cnc[nH]5)C4)C3)nc21 | 10.1021/acs.jmedchem.0c00988 | ||
71720517 | 86579 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
CHEMBL2324200 | 86579 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | ||
127047356 | 139104 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797662 | 139104 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
59456102 | 73529 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2018964 | 73529 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
59455976 | 86727 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 504 | 8 | 3 | 7 | 3.7 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(CO)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326611 | 86727 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 504 | 8 | 3 | 7 | 3.7 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(CO)cccc32)c1 | 10.1021/jm301572h | ||
71583488 | 86732 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 546 | 9 | 2 | 8 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COC2)c1 | 10.1021/jm301572h | ||
CHEMBL2326616 | 86732 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 546 | 9 | 2 | 8 | 3.9 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COC2)c1 | 10.1021/jm301572h | ||
59455990 | 86749 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326632 | 86749 | 0 | None | - | 1 | Human | 6.0 | pKd | = | 6 | Binding | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
59456103 | 86739 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 573 | 9 | 3 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2CCCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326622 | 86739 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 573 | 9 | 3 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2CCCCN2)c1 | 10.1021/jm301572h | ||
56849395 | 86762 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 540 | 9 | 3 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(C)c(F)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326926 | 86762 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 540 | 9 | 3 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(C)c(F)c1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
59456014 | 86738 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 547 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)N)c1 | 10.1021/jm301572h | ||
CHEMBL2326621 | 86738 | 0 | None | - | 1 | Human | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 547 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)N)c1 | 10.1021/jm301572h | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
127045756 | 139339 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799266 | 139339 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
59455988 | 86737 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 547 | 10 | 3 | 8 | 3.8 | CN[C@H](C)C(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326620 | 86737 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 547 | 10 | 3 | 8 | 3.8 | CN[C@H](C)C(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1021/jm301572h | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.ejmech.2016.02.058 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmc.2014.05.021 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1021/jm301572h | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1021/jm301572h | ||
59456050 | 86742 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 589 | 9 | 2 | 9 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COCCN2C)c1 | 10.1021/jm301572h | ||
CHEMBL2326625 | 86742 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 589 | 9 | 2 | 9 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2COCCN2C)c1 | 10.1021/jm301572h | ||
118706830 | 112485 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1nc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310840 | 112485 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1nc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
59456019 | 86747 | 0 | None | - | 1 | Human | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
CHEMBL2326630 | 86747 | 0 | None | - | 1 | Human | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 522 | 8 | 2 | 7 | 4.4 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1021/jm301572h | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmc.2014.05.021 | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1021/jm301572h | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1021/jm301572h | ||
59455975 | 86729 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 518 | 8 | 3 | 7 | 4.3 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326613 | 86729 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 518 | 8 | 3 | 7 | 4.3 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(C)O)cccc32)c1 | 10.1021/jm301572h | ||
59456010 | 86735 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 574 | 9 | 2 | 8 | 4.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCOCC2)c1 | 10.1021/jm301572h | ||
CHEMBL2326619 | 86735 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 574 | 9 | 2 | 8 | 4.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCOCC2)c1 | 10.1021/jm301572h | ||
118706817 | 112472 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 387 | 4 | 3 | 4 | 3.0 | COc1cc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310826 | 112472 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 387 | 4 | 3 | 4 | 3.0 | COc1cc2[nH]c(=O)[nH]c2cc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
58054387 | 86724 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 492 | 7 | 2 | 6 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326609 | 86724 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 492 | 7 | 2 | 6 | 4.4 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1 | 10.1021/jm301572h | ||
58054475 | 86740 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@H]2COCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326623 | 86740 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@H]2COCCN2)c1 | 10.1021/jm301572h | ||
10416 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.ejmech.2016.02.058 | ||
46861584 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL2018969 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.ejmech.2016.02.058 | ||
10416 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
46861584 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
CHEMBL2018969 | 1849 | 23 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1021/jm301572h | ||
59456026 | 86748 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326631 | 86748 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1c(F)ccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
59456058 | 86750 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
CHEMBL2326633 | 86750 | 0 | None | - | 1 | Human | 6.2 | pKd | = | 6.2 | Binding | ChEMBL | 566 | 9 | 3 | 8 | 4.1 | COc1cc(F)cc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)(C)O)c1 | 10.1021/jm301572h | ||
118706831 | 112486 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Binding | ChEMBL | 389 | 4 | 3 | 6 | 1.8 | COc1nc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310841 | 112486 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Binding | ChEMBL | 389 | 4 | 3 | 6 | 1.8 | COc1nc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
58054384 | 86723 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Binding | ChEMBL | 508 | 7 | 2 | 6 | 4.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(Cl)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326608 | 86723 | 0 | None | - | 1 | Human | 5.2 | pKd | = | 5.2 | Binding | ChEMBL | 508 | 7 | 2 | 6 | 4.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(Cl)cccc32)c1 | 10.1021/jm301572h | ||
58054368 | 86741 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2COCCN2)c1 | 10.1021/jm301572h | ||
CHEMBL2326624 | 86741 | 0 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 575 | 9 | 3 | 9 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)[C@@H]2COCCN2)c1 | 10.1021/jm301572h | ||
102143549 | 112484 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1cc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
CHEMBL3310839 | 112484 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 388 | 4 | 3 | 5 | 2.4 | COc1cc2[nH]c(=O)[nH]c2nc1NS(=O)(=O)c1cccc(Cl)c1Cl | 10.1016/j.bmc.2014.05.021 | ||
136116031 | 86375 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 490 | 7 | 3 | 7 | 3.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(O)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2321924 | 86375 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 490 | 7 | 3 | 7 | 3.9 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(O)cccc32)c1 | 10.1021/jm301572h | ||
59456111 | 86734 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 560 | 9 | 2 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCCO2)c1 | 10.1021/jm301572h | ||
CHEMBL2326618 | 86734 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 560 | 9 | 2 | 8 | 4.4 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C2CCCO2)c1 | 10.1021/jm301572h | ||
59456012 | 86731 | 0 | None | - | 1 | Human | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 524 | 8 | 2 | 6 | 5.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(F)F)cccc32)c1 | 10.1021/jm301572h | ||
CHEMBL2326615 | 86731 | 0 | None | - | 1 | Human | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 524 | 8 | 2 | 6 | 5.2 | CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(C(F)F)cccc32)c1 | 10.1021/jm301572h | ||
9827294 | 73517 | 1 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018953 | 73517 | 1 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 499 | 5 | 2 | 7 | 3.7 | O=C([C@H]1CCCCN1)N1CCN(c2nc(NCc3ccc(Cl)cc3Cl)c3cccnc3n2)CC1 | 10.1016/j.bmcl.2012.02.104 | ||
127047356 | 139104 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797662 | 139104 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.5 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(CC4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
127045756 | 139339 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799266 | 139339 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
71462571 | 82158 | 1 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 506 | 8 | 3 | 8 | 3.5 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(NC(=O)CO)c1 | 10.1021/jm300682j | ||
CHEMBL2178575 | 82158 | 1 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 506 | 8 | 3 | 8 | 3.5 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(NC(=O)CO)c1 | 10.1021/jm300682j | ||
10416 | 1849 | 23 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
46861584 | 1849 | 23 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018969 | 1849 | 23 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 10.1016/j.bmcl.2012.02.104 | ||
127047973 | 139235 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 496 | 5 | 1 | 6 | 4.9 | O=C(c1ccccn1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798539 | 139235 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 496 | 5 | 1 | 6 | 4.9 | O=C(c1ccccn1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
127045977 | 139453 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C([C@@H]1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799904 | 139453 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C([C@@H]1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
59455974 | 73526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018961 | 73526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 462 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CN)c1 | 10.1016/j.bmcl.2012.02.104 | ||
16747697 | 93095 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246334 | 93095 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
71457815 | 83571 | 0 | None | -19 | 3 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 3.8 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207091 | 83571 | 0 | None | -19 | 3 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 3.8 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2012.09.020 | ||
71214976 | 83582 | 0 | None | -79 | 3 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 4.5 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207101 | 83582 | 0 | None | -79 | 3 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 4.5 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2012.09.020 | ||
44440045 | 93159 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 443 | 6 | 1 | 4 | 3.2 | CC(C)CN1CCC(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246584 | 93159 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 443 | 6 | 1 | 4 | 3.2 | CC(C)CN1CCC(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440043 | 166314 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 469 | 7 | 1 | 4 | 3.7 | CC(C)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NC2CCN(Cc3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL428576 | 166314 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 469 | 7 | 1 | 4 | 3.7 | CC(C)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NC2CCN(Cc3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2007.03.030 | ||
176 | 394 | 63 | None | -6 | 31 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
2157 | 394 | 63 | None | -6 | 31 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
2566 | 394 | 63 | None | -6 | 31 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
CHEMBL633 | 394 | 63 | None | -6 | 31 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
DB01118 | 394 | 63 | None | -6 | 31 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | nan | ||
59456102 | 73529 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018964 | 73529 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(C)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
127046413 | 139586 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 462 | 6 | 2 | 6 | 3.4 | CNCC(=O)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797946 | 139586 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 462 | 6 | 2 | 6 | 3.4 | CNCC(=O)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3800702 | 139586 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 462 | 6 | 2 | 6 | 3.4 | CNCC(=O)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
59455992 | 73521 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018957 | 73521 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
71461439 | 83567 | 0 | None | -12 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 382 | 5 | 1 | 5 | 3.4 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207087 | 83567 | 0 | None | -12 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 382 | 5 | 1 | 5 | 3.4 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2012.09.020 | ||
71452487 | 83568 | 0 | None | -12 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 382 | 5 | 1 | 5 | 3.4 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cccc(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207088 | 83568 | 0 | None | -12 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 382 | 5 | 1 | 5 | 3.4 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cccc(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
58054487 | 73528 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 504 | 7 | 1 | 7 | 4.3 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(=O)N(C)C)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018963 | 73528 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 504 | 7 | 1 | 7 | 4.3 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(=O)N(C)C)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44440051 | 149083 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 491 | 6 | 0 | 4 | 4.1 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL394714 | 149083 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 491 | 6 | 0 | 4 | 4.1 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
127045976 | 139301 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C([C@H]1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799025 | 139301 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C([C@H]1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
59456051 | 73532 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018967 | 73532 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 520 | 9 | 3 | 8 | 3.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
16747697 | 93095 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246334 | 93095 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440041 | 93103 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 441 | 7 | 1 | 4 | 2.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1S(=O)(=O)Cc1ccccc1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246384 | 93103 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 441 | 7 | 1 | 4 | 2.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1S(=O)(=O)Cc1ccccc1 | 10.1016/j.bmcl.2007.03.030 | ||
71450658 | 83578 | 0 | None | -15 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 4.7 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207098 | 83578 | 0 | None | -15 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 4.7 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
59455973 | 73520 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1ccccc1Cn1nc(NS(=O)(=O)c2ccc(Cl)s2)c2c(OC)cccc21 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018956 | 73520 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1ccccc1Cn1nc(NS(=O)(=O)c2ccc(Cl)s2)c2c(OC)cccc21 | 10.1016/j.bmcl.2012.02.104 | ||
58054491 | 73531 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CNC(C)=O)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018966 | 73531 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 504 | 8 | 2 | 7 | 4.2 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CNC(C)=O)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
127046189 | 139091 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.4 | O=C([C@@H]1CCCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797567 | 139091 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.4 | O=C([C@@H]1CCCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
58054516 | 73523 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018959 | 73523 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 493 | 8 | 1 | 8 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1OC | 10.1016/j.bmcl.2012.02.104 | ||
15604497 | 83579 | 0 | None | -79 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 432 | 5 | 1 | 7 | 3.0 | Cn1nnnc1Cc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207099 | 83579 | 0 | None | -79 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 432 | 5 | 1 | 7 | 3.0 | Cn1nnnc1Cc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
11525206 | 134705 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL372399 | 134705 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 448 | 5 | 2 | 6 | 3.2 | O=C([C@H]1CCCCN1)N1CCN(c2nccc(NCc3ccc(Cl)cc3Cl)n2)CC1 | 10.1016/j.ejmech.2016.02.058 | ||
127046247 | 139086 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 488 | 6 | 2 | 6 | 4.8 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797537 | 139086 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 488 | 6 | 2 | 6 | 4.8 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
44440135 | 92903 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 477 | 6 | 1 | 4 | 3.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245319 | 92903 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 477 | 6 | 1 | 4 | 3.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
44440081 | 92965 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 582 | 8 | 1 | 5 | 3.9 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(N)=O)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245730 | 92965 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 582 | 8 | 1 | 5 | 3.9 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(N)=O)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
127045978 | 139152 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.4 | O=C([C@H]1CCCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797980 | 139152 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.4 | O=C([C@H]1CCCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
127045975 | 139200 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C(C1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798263 | 139200 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 4.0 | O=C(C1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
127046787 | 139386 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 502 | 5 | 1 | 6 | 4.0 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(C(=O)C4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799514 | 139386 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 502 | 5 | 1 | 6 | 4.0 | CN(Cc1ccc(Cl)cc1Cl)c1ccnc(N2CCC3(CCN(C(=O)C4CCCN4)C3)CC2)n1 | 10.1016/j.ejmech.2016.02.058 | ||
127046613 | 139443 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 456 | 5 | 2 | 6 | 2.9 | O=C(C1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(F)cc4F)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799865 | 139443 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 456 | 5 | 2 | 6 | 2.9 | O=C(C1CCCN1)N1CCC2(CCN(c3nccc(NCc4ccc(F)cc4F)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
44440031 | 148971 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 427 | 6 | 1 | 3 | 4.6 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1Cc1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL394642 | 148971 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 427 | 6 | 1 | 3 | 4.6 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1Cc1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
70689680 | 73519 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018955 | 73519 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 6 | 1 | 6 | 4.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1 | 10.1016/j.bmcl.2012.02.104 | ||
59456072 | 73522 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018958 | 73522 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 463 | 7 | 1 | 7 | 4.6 | COc1ccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
70681287 | 73525 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1CO | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018960 | 73525 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccccc1CO | 10.1016/j.bmcl.2012.02.104 | ||
71461438 | 83562 | 0 | None | -251 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1cnnc1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207082 | 83562 | 0 | None | -251 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1cnnc1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
71461440 | 83577 | 0 | None | -79 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 5 | 1 | 5 | 3.6 | O=S(=O)(Nc1cc(F)ccc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207097 | 83577 | 0 | None | -79 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 400 | 5 | 1 | 5 | 3.6 | O=S(=O)(Nc1cc(F)ccc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
44440072 | 93096 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 557 | 7 | 0 | 4 | 5.0 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2F)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246335 | 93096 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 557 | 7 | 0 | 4 | 5.0 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2F)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440047 | 93160 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 491 | 6 | 0 | 4 | 4.1 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc2ccccc12)C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246585 | 93160 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 491 | 6 | 0 | 4 | 4.1 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc2ccccc12)C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440083 | 150278 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 554 | 7 | 1 | 5 | 4.4 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2N)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL395680 | 150278 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 554 | 7 | 1 | 5 | 4.4 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2N)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440059 | 93091 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 553 | 8 | 0 | 4 | 5.2 | CCN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246328 | 93091 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 553 | 8 | 0 | 4 | 5.2 | CCN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.ejmech.2016.02.058 | ||
127046614 | 139396 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799578 | 139396 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 6 | 2 | 6 | 3.4 | Fc1ccc(CNc2ccnc(N3CCC4(CCN(CC5CCCN5)C4)CC3)n2)c(F)c1 | 10.1016/j.ejmech.2016.02.058 | ||
9959269 | 73518 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018954 | 73518 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 550 | 11 | 1 | 8 | 3.9 | COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)C | 10.1016/j.bmcl.2012.02.104 | ||
127046612 | 139220 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798452 | 139220 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
127046412 | 139584 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 391 | 4 | 2 | 5 | 4.0 | Clc1ccc(CNc2ccnc(N3CCC4(CCNC4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797678 | 139584 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 391 | 4 | 2 | 5 | 4.0 | Clc1ccc(CNc2ccnc(N3CCC4(CCNC4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3800700 | 139584 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 391 | 4 | 2 | 5 | 4.0 | Clc1ccc(CNc2ccnc(N3CCC4(CCNC4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
58054532 | 73527 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 490 | 7 | 2 | 7 | 4.0 | CNC(=O)c1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018962 | 73527 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 490 | 7 | 2 | 7 | 4.0 | CNC(=O)c1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(OC)cccc32)c1 | 10.1016/j.bmcl.2012.02.104 | ||
71456007 | 83572 | 0 | None | -1 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 373 | 5 | 1 | 6 | 2.7 | N#Cc1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cn2ccnn2)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207092 | 83572 | 0 | None | -1 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 373 | 5 | 1 | 6 | 2.7 | N#Cc1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cn2ccnn2)c1 | 10.1016/j.bmcl.2012.09.020 | ||
71456008 | 83575 | 0 | None | -50 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 404 | 5 | 1 | 6 | 4.0 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1csc2ccccc12 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207095 | 83575 | 0 | None | -50 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 404 | 5 | 1 | 6 | 4.0 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1csc2ccccc12 | 10.1016/j.bmcl.2012.09.020 | ||
70685473 | 73515 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018951 | 73515 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CO)c1 | 10.1016/j.bmcl.2012.02.104 | ||
59456003 | 73516 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018952 | 73516 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 476 | 7 | 2 | 7 | 3.7 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(C(N)=O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
15985912 | 83561 | 0 | None | -2 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207081 | 83561 | 0 | None | -2 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
71450657 | 83574 | 0 | None | -15 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cc(Cl)c(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207094 | 83574 | 0 | None | -15 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1cc(Cl)c(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
71452488 | 83573 | 0 | None | -79 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 3.5 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207093 | 83573 | 0 | None | -79 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 3.5 | O=S(=O)(Nc1cc(Cl)ccc1Cn1ccnn1)c1ccc(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
44440076 | 150874 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2cccc(Cl)c2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL396166 | 150874 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2cccc(Cl)c2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440084 | 93004 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 607 | 7 | 0 | 4 | 5.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245931 | 93004 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 607 | 7 | 0 | 4 | 5.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
3117 | 206106 | 100 | None | -4 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | nan | ||
CHEMBL964 | 206106 | 100 | None | -4 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | nan | ||
44440075 | 92905 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2Cl)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245331 | 92905 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2Cl)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440028 | 93445 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 477 | 6 | 1 | 4 | 3.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL247976 | 93445 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 477 | 6 | 1 | 4 | 3.8 | O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2007.03.030 | ||
44440079 | 92932 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 569 | 8 | 0 | 5 | 4.8 | COc1cccc(CCN2CCC(N(C)C(=O)[C@@H]3CCCN3S(=O)(=O)c3ccc4c(Cl)cccc4c3)CC2)c1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245531 | 92932 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 569 | 8 | 0 | 5 | 4.8 | COc1cccc(CCN2CCC(N(C)C(=O)[C@@H]3CCCN3S(=O)(=O)c3ccc4c(Cl)cccc4c3)CC2)c1 | 10.1016/j.bmcl.2007.03.030 | ||
127047612 | 139362 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3799393 | 139362 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 474 | 6 | 2 | 6 | 4.4 | Clc1ccc(CNc2ccnc(N3CCC4(CCN(C[C@H]5CCCN5)C4)CC3)n2)c(Cl)c1 | 10.1016/j.ejmech.2016.02.058 | ||
127047970 | 139292 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.2 | O=C(C1CCCNC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798949 | 139292 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 502 | 5 | 2 | 6 | 4.2 | O=C(C1CCCNC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
127046191 | 139585 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 3.8 | O=C(C1CCNC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3798941 | 139585 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 3.8 | O=C(C1CCNC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3800701 | 139585 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 488 | 5 | 2 | 6 | 3.8 | O=C(C1CCNC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
70693879 | 73074 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CO)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2016602 | 73074 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 463 | 7 | 2 | 7 | 4.1 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1ccc(CO)cc1 | 10.1016/j.bmcl.2012.02.104 | ||
16747697 | 93095 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246334 | 93095 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 539 | 7 | 0 | 4 | 4.8 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
71454246 | 83569 | 0 | None | -1 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 376 | 5 | 1 | 5 | 3.4 | Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2Cn2ccnn2)cc1C | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207089 | 83569 | 0 | None | -1 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 376 | 5 | 1 | 5 | 3.4 | Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2Cn2ccnn2)cc1C | 10.1016/j.bmcl.2012.09.020 | ||
71454248 | 83581 | 0 | None | -39 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.1 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1ccc(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207100 | 83581 | 0 | None | -39 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.1 | O=S(=O)(Nc1cc(Cl)c(Cl)cc1Cn1ccnn1)c1ccc(Cl)s1 | 10.1016/j.bmcl.2012.09.020 | ||
44440080 | 152825 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 583 | 8 | 1 | 5 | 4.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(=O)O)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL397848 | 152825 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 583 | 8 | 1 | 5 | 4.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccccc2C(=O)O)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440054 | 93262 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 505 | 7 | 0 | 4 | 4.2 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL246986 | 93262 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 505 | 7 | 0 | 4 | 4.2 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440055 | 152819 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 519 | 8 | 0 | 4 | 4.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(CCCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL397845 | 152819 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 519 | 8 | 0 | 4 | 4.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)C1CCN(CCCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
71214725 | 83563 | 0 | None | -15 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1cncn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207083 | 83563 | 0 | None | -15 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 416 | 5 | 1 | 5 | 4.1 | O=S(=O)(Nc1cc(Cl)ccc1Cn1cncn1)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
71214710 | 83565 | 0 | None | -39 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 431 | 5 | 1 | 6 | 3.6 | Cn1nnnc1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
CHEMBL2207085 | 83565 | 0 | None | -39 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 431 | 5 | 1 | 6 | 3.6 | Cn1nnnc1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmcl.2012.09.020 | ||
127047972 | 139090 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 501 | 5 | 1 | 5 | 5.8 | O=C(C1CCCCC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
CHEMBL3797555 | 139090 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 501 | 5 | 1 | 5 | 5.8 | O=C(C1CCCCC1)N1CCC2(CCN(c3nccc(NCc4ccc(Cl)cc4Cl)n3)CC2)C1 | 10.1016/j.ejmech.2016.02.058 | ||
59456067 | 73533 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
CHEMBL2018968 | 73533 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 534 | 9 | 3 | 8 | 3.6 | COc1cccc2c1c(NS(=O)(=O)c1ccc(Cl)s1)nn2Cc1cccc(CNC(=O)C(C)O)c1 | 10.1016/j.bmcl.2012.02.104 | ||
44440077 | 92906 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245332 | 92906 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 573 | 7 | 0 | 4 | 5.5 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(Cl)cccc2c1)C1CCN(CCc2ccc(Cl)cc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
44440065 | 92902 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 523 | 7 | 0 | 4 | 4.3 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(F)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
CHEMBL245313 | 92902 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 523 | 7 | 0 | 4 | 4.3 | CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(F)cccc2c1)C1CCN(CCc2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.030 | ||
10416 | 1849 | 23 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | Guide to Pharmacology | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 23409871 | ||
46861584 | 1849 | 23 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | Guide to Pharmacology | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 23409871 | ||
CHEMBL2018969 | 1849 | 23 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | Guide to Pharmacology | 548 | 9 | 3 | 8 | 4.0 | COc1cccc2c1c(nn2Cc1cccc(c1)CNC(=O)C(O)(C)C)NS(=O)(=O)c1ccc(s1)Cl | 23409871 | ||
176 | 394 | 63 | None | -6 | 31 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | None | ||
2157 | 394 | 63 | None | -6 | 31 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | None | ||
2566 | 394 | 63 | None | -6 | 31 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | None | ||
CHEMBL633 | 394 | 63 | None | -6 | 31 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | None | ||
DB01118 | 394 | 63 | None | -6 | 31 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | None | ||
3117 | 206106 | 100 | None | -4 | 16 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | None | ||
CHEMBL964 | 206106 | 100 | None | -4 | 16 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 296 | 4 | 0 | 4 | 3.6 | CCN(CC)C(=S)SSC(=S)N(CC)CC | None |