Ligand source activities (1 row/activity)
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
9868867 | 193901 | 0 | None | - | 1 | Mouse | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL491667 | 193901 | 0 | None | - | 1 | Mouse | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
1894 | 7744 | 41 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5311053 | 7744 | 41 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL37853 | 7744 | 41 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
DB11507 | 7744 | 41 | None | 229 | 5 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | ||
134157766 | 160829 | 0 | None | -1 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3984438 | 160829 | 0 | None | -1 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
134149776 | 155282 | 0 | None | 43 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3938300 | 155282 | 0 | None | 43 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.6 | O=C(O)CC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
134151657 | 159893 | 0 | None | 1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3976382 | 159893 | 0 | None | 1 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
1959 | 7446 | 41 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
5283081 | 7446 | 41 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3914661 | 7446 | 41 | None | 1737 | 2 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10.1021/acsmedchemlett.6b00415 | ||
1884 | 9857 | 52 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
5280363 | 9857 | 52 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
912 | 9857 | 52 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
CHEMBL815 | 9857 | 52 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
DB12789 | 9857 | 52 | None | -2 | 9 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
13174090 | 158909 | 9 | None | -17 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 388 | 11 | 3 | 5 | 2.8 | O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3967903 | 158909 | 9 | None | -17 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 388 | 11 | 3 | 5 | 2.8 | O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
14429703 | 149150 | 0 | None | -5248 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 467 | 12 | 4 | 7 | 1.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3889508 | 149150 | 0 | None | -5248 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 467 | 12 | 4 | 7 | 1.5 | CS(=O)(=O)NC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/acsmedchemlett.6b00415 | ||
44393462 | 73621 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL186192 | 73621 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
44393438 | 72938 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL184264 | 72938 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
71552665 | 93852 | 0 | None | - | 1 | Mouse | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 450 | 9 | 4 | 8 | 0.9 | NS(=O)(=O)c1ccc(-n2cc([C@H]3[C@H](O)C[C@H](O)[C@@H]3C/C=C\CCCC(=O)O)nn2)cc1 | 10.1016/j.bmcl.2012.12.058 | ||
CHEMBL2326219 | 93852 | 0 | None | - | 1 | Mouse | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 450 | 9 | 4 | 8 | 0.9 | NS(=O)(=O)c1ccc(-n2cc([C@H]3[C@H](O)C[C@H](O)[C@@H]3C/C=C\CCCC(=O)O)nn2)cc1 | 10.1016/j.bmcl.2012.12.058 | ||
6438324 | 73465 | 2 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL185484 | 73465 | 2 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
68749474 | 153011 | 0 | None | -1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3920347 | 153011 | 0 | None | -1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
44393448 | 72354 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL183193 | 72354 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
44393474 | 129771 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL360869 | 129771 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | ||
1884 | 9857 | 52 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
5280363 | 9857 | 52 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
912 | 9857 | 52 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL815 | 9857 | 52 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
DB12789 | 9857 | 52 | None | -2 | 9 | Mouse | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | ||
1884 | 9857 | 52 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
5280363 | 9857 | 52 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
912 | 9857 | 52 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL815 | 9857 | 52 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
DB12789 | 9857 | 52 | None | -2 | 9 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | ||
44393451 | 175029 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL433752 | 175029 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
1883 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
1916 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
5280360 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
913 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
CHEMBL548 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
DB00917 | 9856 | 75 | None | -162 | 12 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10.1021/acsmedchemlett.5b00455 | ||
44393422 | 131183 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL363946 | 131183 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
56839536 | 149947 | 0 | None | -15 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
CHEMBL3896035 | 149947 | 0 | None | -15 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 604 | 15 | 2 | 7 | 5.1 | CCCCCCCCNC(=O)c1coc([C@@H]2CCCN2Cc2cc(F)ccc2CCC(=O)NS(=O)(=O)C(F)(F)F)n1 | nan | ||
56839342 | 155786 | 0 | None | -26 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
CHEMBL3942394 | 155786 | 0 | None | -26 | 7 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 646 | 13 | 2 | 7 | 6.0 | O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
68747479 | 158900 | 0 | None | -7 | 2 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3967855 | 158900 | 0 | None | -7 | 2 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
134147356 | 156391 | 0 | None | -123 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3947086 | 156391 | 0 | None | -123 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 404 | 9 | 3 | 5 | 3.0 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
44393601 | 71634 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL182117 | 71634 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
44564518 | 199948 | 0 | None | - | 1 | Mouse | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL523143 | 199948 | 0 | None | - | 1 | Mouse | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
1940 | 8444 | 41 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
3417 | 8444 | 41 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
5311100 | 8444 | 41 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL1201379 | 8444 | 41 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
DB11519 | 8444 | 41 | None | 933 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10.1021/acsmedchemlett.6b00415 | ||
68785185 | 157595 | 0 | None | 7 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3956817 | 157595 | 0 | None | 7 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 8 | 3 | 5 | 2.8 | O=C(O)CC[C@@H]1CCC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
1960 | 9065 | 42 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
6441636 | 9065 | 42 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL1050 | 9065 | 42 | None | - | 1 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | ||
127052613 | 146984 | 0 | None | -39 | 6 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 7 | 3 | 7 | 3.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/[C@@H](O)COc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
CHEMBL3804978 | 146984 | 0 | None | -39 | 6 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 7 | 3 | 7 | 3.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/[C@@H](O)COc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
5282380 | 131821 | 41 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL364375 | 131821 | 41 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
56649302 | 159445 | 0 | None | -9 | 6 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 630 | 13 | 2 | 7 | 5.5 | O=C(CCc1ccc(F)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
CHEMBL3972583 | 159445 | 0 | None | -9 | 6 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 630 | 13 | 2 | 7 | 5.5 | O=C(CCc1ccc(F)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F | nan | ||
56839344 | 158830 | 0 | None | -1202 | 8 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
CHEMBL3967284 | 158830 | 0 | None | -1202 | 8 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 656 | 13 | 2 | 9 | 5.1 | O=C(CCc1cc2c(cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC3CCCCC3)co1)OCO2)NS(=O)(=O)C(F)(F)F | nan | ||
127052614 | 147004 | 0 | None | -97 | 6 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 415 | 7 | 2 | 6 | 4.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
CHEMBL3805176 | 147004 | 0 | None | -97 | 6 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 415 | 7 | 2 | 6 | 4.1 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
71552411 | 93834 | 0 | None | - | 1 | Mouse | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 516 | 14 | 5 | 9 | 2.1 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)Nc1nnc(S(N)(=O)=O)s1 | 10.1016/j.bmcl.2012.12.058 | ||
CHEMBL2325977 | 93834 | 0 | None | - | 1 | Mouse | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 516 | 14 | 5 | 9 | 2.1 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)Nc1nnc(S(N)(=O)=O)s1 | 10.1016/j.bmcl.2012.12.058 | ||
6443852 | 160627 | 5 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3982726 | 160627 | 5 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
134138103 | 154658 | 0 | None | 12 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3933326 | 154658 | 0 | None | 12 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 418 | 10 | 3 | 5 | 3.4 | O=C(O)CCCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
56839343 | 151057 | 0 | None | -12 | 6 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 642 | 14 | 2 | 8 | 5.4 | COc1ccc(CCC(=O)NS(=O)(=O)C(F)(F)F)c(CN2CCC[C@H]2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | nan | ||
CHEMBL3904989 | 151057 | 0 | None | -12 | 6 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 642 | 14 | 2 | 8 | 5.4 | COc1ccc(CCC(=O)NS(=O)(=O)C(F)(F)F)c(CN2CCC[C@H]2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1 | nan | ||
44564468 | 199486 | 0 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL521964 | 199486 | 0 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | ||
5311239 | 137396 | 31 | None | 5 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL36817 | 137396 | 31 | None | 5 | 3 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
9845493 | 193884 | 0 | None | - | 1 | Mouse | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL491474 | 193884 | 0 | None | - | 1 | Mouse | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
68747456 | 152544 | 0 | None | 5 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 388 | 8 | 3 | 5 | 2.6 | O=C(O)CCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3916674 | 152544 | 0 | None | 5 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 388 | 8 | 3 | 5 | 2.6 | O=C(O)CCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
44393420 | 72934 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL184249 | 72934 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
44393607 | 104880 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL273444 | 104880 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | ||
44393436 | 129762 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL360862 | 129762 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | ||
1960 | 9065 | 42 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
6441636 | 9065 | 42 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
CHEMBL1050 | 9065 | 42 | None | - | 1 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmcl.2012.12.058 | ||
44564520 | 193568 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL489109 | 193568 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | ||
9825293 | 106831 | 9 | None | 83 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL287080 | 106831 | 9 | None | 83 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
68747472 | 154562 | 0 | None | 7 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 402 | 9 | 3 | 5 | 3.0 | O=C(O)CCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3932636 | 154562 | 0 | None | 7 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 402 | 9 | 3 | 5 | 3.0 | O=C(O)CCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
44393431 | 73481 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL185559 | 73481 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
44564519 | 193885 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
CHEMBL491475 | 193885 | 0 | None | - | 1 | Mouse | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | ||
69753740 | 147000 | 0 | None | -1 | 5 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3805134 | 147000 | 0 | None | -1 | 5 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 390 | 9 | 3 | 5 | 2.8 | O=C(O)CCC[C@H]1CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)O1 | 10.1021/acsmedchemlett.6b00415 | ||
68751402 | 151015 | 0 | None | -5 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 416 | 10 | 3 | 5 | 3.3 | O=C(O)CCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3904644 | 151015 | 0 | None | -5 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 416 | 10 | 3 | 5 | 3.3 | O=C(O)CCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
44393457 | 130997 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL363439 | 130997 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
1884 | 9857 | 52 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5280363 | 9857 | 52 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
912 | 9857 | 52 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL815 | 9857 | 52 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
DB12789 | 9857 | 52 | None | -2 | 9 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
10389527 | 160124 | 19 | None | 1122 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL39784 | 160124 | 19 | None | 1122 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | ||
126495491 | 147003 | 0 | None | -660 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 2 | 6 | 4.5 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
CHEMBL3805169 | 147003 | 0 | None | -660 | 4 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 2 | 6 | 4.5 | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/CCCOc3ccccc3)O2)n1 | 10.1021/acsmedchemlett.5b00455 | ||
134144861 | 157460 | 0 | None | 7 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 430 | 11 | 3 | 5 | 3.7 | O=C(O)CCCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
CHEMBL3955821 | 157460 | 0 | None | 7 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 430 | 11 | 3 | 5 | 3.7 | O=C(O)CCCCCC1=CC[C@H]2[C@H](C[C@@H](O)[C@@H]2/C=C/[C@@H](O)COc2ccccc2)OC1 | 10.1021/acsmedchemlett.6b00415 | ||
44393443 | 73462 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
CHEMBL185466 | 73462 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | ||
1955 | 6805 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
5311240 | 6805 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL36041 | 6805 | 1 | None | 1258 | 5 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | ||
6441607 | 161858 | 28 | None | -1 | 4 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
CHEMBL40183 | 161858 | 28 | None | -1 | 4 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | ||
142451571 | 187194 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4752237 | 187194 | 0 | None | - | 1 | Human | 9.3 | pIC50 | = | 9.3 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
135357370 | 187000 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4749822 | 187000 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
142451571 | 187194 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4752237 | 187194 | 0 | None | - | 1 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
142451214 | 186994 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4749767 | 186994 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135357321 | 187377 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4754421 | 187377 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
118948515 | 189305 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 477 | 4 | 2 | 3 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(N)=O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4787228 | 189305 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 477 | 4 | 2 | 3 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(N)=O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
11283 | 7373 | 10 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
146368333 | 7373 | 10 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4643852 | 7373 | 10 | None | -1 | 4 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | ||
142451571 | 187194 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4752237 | 187194 | 0 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
162658978 | 188107 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4762787 | 188107 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
118948617 | 186177 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 2 | 3 | 5.3 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2[n+]([O-])c1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4739939 | 186177 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 494 | 4 | 2 | 3 | 5.3 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2[n+]([O-])c1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
142451618 | 186344 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 565 | 8 | 2 | 4 | 5.8 | Cc1c(N2CC(F)(F)C2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4741813 | 186344 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 565 | 8 | 2 | 4 | 5.8 | Cc1c(N2CC(F)(F)C2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135358158 | 188022 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4761670 | 188022 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL1910324 | 215857 | 1 | None | -1 | 3 | Bovine | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
CHEMBL1910324 | 215857 | 1 | None | 1 | 3 | Mouse | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
CHEMBL1910324 | 215857 | 1 | None | -1 | 3 | Sheep | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O | 10.1021/jm200608k | ||||
130405592 | 189518 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 4 | 2 | 2 | 6.7 | Cc1c(-c2ccccc2)cc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4789967 | 189518 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 477 | 4 | 2 | 2 | 6.7 | Cc1c(-c2ccccc2)cc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
130405404 | 187530 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 456 | 4 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(C(C)(C)C)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4756068 | 187530 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 456 | 4 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(C(C)(C)C)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
162659434 | 188027 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4761725 | 188027 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
118948371 | 188215 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 460 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4764092 | 188215 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 460 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1 | 10.1021/acs.jmedchem.0c00834 | ||
162653447 | 187278 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 459 | 5 | 0 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)N(C)CCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4753259 | 187278 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 459 | 5 | 0 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)N(C)CCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
118948324 | 186636 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 498 | 4 | 2 | 3 | 6.4 | O=C(O)c1ccc(NC(=O)c2c(Cl)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4745363 | 186636 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 498 | 4 | 2 | 3 | 6.4 | O=C(O)c1ccc(NC(=O)c2c(Cl)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
162671048 | 189586 | 0 | None | 2 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4790821 | 189586 | 0 | None | 2 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
142451214 | 186994 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4749767 | 186994 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 586 | 8 | 2 | 3 | 7.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
162655188 | 187496 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C)c1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4755674 | 187496 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C)c1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
135357254 | 188553 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1cccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)c1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4777724 | 188553 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1cccc(C(CNC(=O)c2c(C)c(-c3ccccc3)nc3ccc(Br)cc23)CC(=O)O)c1 | 10.1021/acs.jmedchem.0c00834 | ||
118948280 | 187133 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 434 | 4 | 2 | 3 | 6.0 | Cc1c(-c2ccccc2)nc2ccc(Cl)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4751462 | 187133 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 434 | 4 | 2 | 3 | 6.0 | Cc1c(-c2ccccc2)nc2ccc(Cl)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
162644141 | 188619 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4778430 | 188619 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
162655888 | 187531 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 464 | 5 | 2 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1CNc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4756085 | 187531 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 464 | 5 | 2 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1CNc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
162659434 | 188027 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4761725 | 188027 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 488 | 6 | 1 | 3 | 6.5 | COc1ccccc1C(C)CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12 | 10.1021/acs.jmedchem.0c00834 | ||
162671748 | 189589 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 465 | 5 | 1 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1COc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4790875 | 189589 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 465 | 5 | 1 | 3 | 6.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1COc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
135357370 | 187000 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4749822 | 187000 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 593 | 8 | 2 | 4 | 6.6 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1c(F)ccc(F)c1Cl | 10.1021/acs.jmedchem.0c00834 | ||
118947820 | 187517 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 478 | 4 | 2 | 3 | 6.1 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4755942 | 187517 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 478 | 4 | 2 | 3 | 6.1 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
118948258 | 187888 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 504 | 5 | 2 | 3 | 6.6 | O=C(O)c1ccc(NC(=O)c2c(C3CC3)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4760232 | 187888 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 504 | 5 | 2 | 3 | 6.6 | O=C(O)c1ccc(NC(=O)c2c(C3CC3)c(-c3ccccc3)nc3ccc(Br)cc23)c(F)c1 | 10.1021/acs.jmedchem.0c00834 | ||
135357195 | 186426 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4743035 | 186426 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135357378 | 186552 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4744552 | 186552 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
162649924 | 186892 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4748513 | 186892 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 445 | 5 | 1 | 3 | 5.3 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | ||
135357378 | 186552 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4744552 | 186552 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 536 | 7 | 2 | 3 | 6.6 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135357195 | 186426 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4743035 | 186426 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 522 | 6 | 2 | 3 | 6.2 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(C(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
142451544 | 189145 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4784864 | 189145 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135357321 | 187377 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4754421 | 187377 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 564 | 9 | 2 | 3 | 7.4 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
142451565 | 188705 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4779694 | 188705 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
130405858 | 187821 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 494 | 4 | 2 | 4 | 5.2 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2c(=O)n1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4759438 | 187821 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 494 | 4 | 2 | 4 | 5.2 | Cc1c(C(=O)Nc2ccc(C(=O)O)cc2F)c2cc(Br)ccc2c(=O)n1-c1ccccc1 | 10.1021/acs.jmedchem.0c00834 | ||
142451544 | 189145 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4784864 | 189145 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 571 | 8 | 2 | 4 | 6.7 | Cc1c(N2CCCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
162651877 | 187028 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 502 | 4 | 2 | 5 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(-c2nnn[nH]2)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4750252 | 187028 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 502 | 4 | 2 | 5 | 5.5 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)Nc1ccc(-c2nnn[nH]2)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
142451565 | 188705 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4779694 | 188705 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 557 | 8 | 2 | 4 | 6.3 | Cc1c(N2CCCCC2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
162664851 | 188913 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC(C)Cc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4782206 | 188913 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 459 | 5 | 1 | 3 | 5.7 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC(C)Cc1ccccn1 | 10.1021/acs.jmedchem.0c00834 | ||
130405401 | 187058 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 526 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(I)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4750703 | 187058 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 526 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(I)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
122551092 | 189453 | 1 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC12CCC(C(=O)O)(CC1)CC2 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4789100 | 189453 | 1 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 2 | 3 | 5.9 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NC12CCC(C(=O)O)(CC1)CC2 | 10.1021/acs.jmedchem.0c00834 | ||
162651613 | 187064 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | Cc1c(N2CCCC2)nc2ccc(Br)cc2c1C(=O)NC[C@@H](CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4750758 | 187064 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | Cc1c(N2CCCC2)nc2ccc(Br)cc2c1C(=O)NC[C@@H](CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
142451571 | 187194 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4752237 | 187194 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 585 | 9 | 2 | 4 | 7.0 | CCC1CCCN(c2nc3ccc(Br)cc3c(C(=O)NCC(CCC(=O)O)c3ccccc3Cl)c2C)C1 | 10.1021/acs.jmedchem.0c00834 | ||
135357792 | 186449 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4743411 | 186449 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135357792 | 186449 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4743411 | 186449 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 550 | 8 | 2 | 3 | 7.0 | Cc1c(-c2ccccc2)nc2ccc(Br)cc2c1C(=O)NCC(CCC(=O)O)c1ccccc1Cl | 10.1021/acs.jmedchem.0c00834 | ||
135358158 | 188022 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4761670 | 188022 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 532 | 8 | 2 | 4 | 6.0 | COc1ccccc1C(CNC(=O)c1c(C)c(-c2ccccc2)nc2ccc(Br)cc12)CC(=O)O | 10.1021/acs.jmedchem.0c00834 | ||
118948479 | 188940 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 468 | 4 | 2 | 3 | 6.3 | Cc1c(-c2ccccc2)nc2ccc(C(F)(F)F)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
CHEMBL4782468 | 188940 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 468 | 4 | 2 | 3 | 6.3 | Cc1c(-c2ccccc2)nc2ccc(C(F)(F)F)cc2c1C(=O)Nc1ccc(C(=O)O)cc1F | 10.1021/acs.jmedchem.0c00834 | ||
10402929 | 64317 | 0 | None | - | 0 | Human | 4.4 | pKi | = | 4.4 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL166351 | 64317 | 0 | None | - | 0 | Human | 4.4 | pKi | = | 4.4 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)c(Cl)c1 | 10.1016/s0960-894x(01)00056-7 | ||
44377464 | 126863 | 0 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL350832 | 126863 | 0 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 306 | 4 | 1 | 1 | 4.7 | O=C(O)/C=C/c1ccccc1Cc1ccc(Cl)cc1Cl | 10.1016/s0960-894x(01)00056-7 | ||
9817405 | 172182 | 5 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
CHEMBL423815 | 172182 | 5 | None | - | 0 | Human | 4.2 | pKi | = | 4.2 | Functional | ChEMBL | 288 | 4 | 1 | 1 | 4.5 | O=C(O)/C=C/c1ccccc1Cc1ccc2ccccc2c1 | 10.1016/s0960-894x(01)00056-7 | ||
1884 | 9857 | 52 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
5280363 | 9857 | 52 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
912 | 9857 | 52 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
CHEMBL815 | 9857 | 52 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
DB12789 | 9857 | 52 | None | -2 | 9 | Mouse | 8.1 | pEC50 | = | 8.1 | Functional | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | ||
7452 | 10508 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 4 | 3.8 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/C(COc1ccccc1)(F)F)O | 15037111 | ||
9978917 | 10508 | 0 | None | - | 1 | Human | 9.3 | pEC50 | = | 9.3 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 4 | 3.8 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/C(COc1ccccc1)(F)F)O | 15037111 | ||
3386 | 7111 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 5 | 3.2 | OC(=O)CC/C=C\CC[C@@H]1[C@@H](/C=C/[C@H](COc2cccc(c2)Cl)O)OC[C@@H]1O | 17076623 | ||
59107184 | 7111 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 410 | 11 | 3 | 5 | 3.2 | OC(=O)CC/C=C\CC[C@@H]1[C@@H](/C=C/[C@H](COc2cccc(c2)Cl)O)OC[C@@H]1O | 17076623 | ||
1956 | 7113 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
1956 | 7113 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
5311238 | 7113 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
5311238 | 7113 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
CHEMBL1332680 | 7113 | 0 | None | -1 | 2 | Mouse | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
CHEMBL1332680 | 7113 | 0 | None | 1 | 2 | Rat | 6.7 | pEC50 | None | 6.7 | Functional | Guide to Pharmacology | 402 | 9 | 3 | 3 | 3.9 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H]([C@@H]1/C=C/[C@@H](C1Cc2c(C1)cccc2)O)F | 10454504 | ||
1958 | 7445 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
371 | 7445 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
5311027 | 7445 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
CHEMBL1200963 | 7445 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
DB00905 | 7445 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | Guide to Pharmacology | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 12606640 | ||
50902259 | 9713 | 1 | None | -301 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
9875 | 9713 | 1 | None | -301 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
CHEMBL4297633 | 9713 | 1 | None | -301 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
DB12043 | 9713 | 1 | None | -301 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | ||
1959 | 7446 | 41 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
5283081 | 7446 | 41 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
CHEMBL3914661 | 7446 | 41 | None | 1737 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | Guide to Pharmacology | 388 | 11 | 4 | 4 | 3.1 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | 10952685 | ||
1955 | 6805 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 | ||
5311240 | 6805 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 | ||
CHEMBL36041 | 6805 | 1 | None | 1258 | 5 | Human | 8.8 | pIC50 | None | 8.8 | Functional | Guide to Pharmacology | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10715159 |
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
68749980 | 195840 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 440 | 9 | 3 | 5 | 3.3 | O=C(O)CCC[C@H]1CC[C@@H]2[C@@H](/C=C/[C@@H](O)COc3cc(F)ccc3F)[C@H](O)C[C@@H]2OC1 | 10.1016/j.ejmech.2021.113842 | |||
CHEMBL5095395 | 195840 | 0 | None | - | 0 | Human | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 440 | 9 | 3 | 5 | 3.3 | O=C(O)CCC[C@H]1CC[C@@H]2[C@@H](/C=C/[C@@H](O)COc3cc(F)ccc3F)[C@H](O)C[C@@H]2OC1 | 10.1016/j.ejmech.2021.113842 | |||
50902259 | 9713 | 1 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 10.1016/j.ejmech.2021.113842 | |||
9875 | 9713 | 1 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 10.1016/j.ejmech.2021.113842 | |||
CHEMBL4297633 | 9713 | 1 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 10.1016/j.ejmech.2021.113842 | |||
DB12043 | 9713 | 1 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 10.1016/j.ejmech.2021.113842 | |||
1955 | 6805 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
5311240 | 6805 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL36041 | 6805 | 1 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
1894 | 7744 | 41 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | |||
5311053 | 7744 | 41 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL37853 | 7744 | 41 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | |||
DB11507 | 7744 | 41 | None | 1 | 5 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1016/s0960-894x(00)00273-0 | |||
9825293 | 106831 | 9 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL287080 | 106831 | 9 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 456 | 11 | 4 | 4 | 4.1 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
44354547 | 123357 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 390 | 12 | 5 | 4 | 2.7 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)O | 10.1021/jm010264b | |||
CHEMBL336543 | 123357 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 390 | 12 | 5 | 4 | 2.7 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)O | 10.1021/jm010264b | |||
44571206 | 190768 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 574 | 6 | 1 | 5 | 6.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc3ccccc3c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL481813 | 190768 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 574 | 6 | 1 | 5 | 6.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc3ccccc3c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
10047541 | 139288 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 416 | 13 | 4 | 6 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccs1 | 10.1021/jm990542v | |||
CHEMBL369797 | 139288 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 416 | 13 | 4 | 6 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccs1 | 10.1021/jm990542v | |||
11283 | 7373 | 10 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
44322535 | 213401 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 12 | 5 | 7 | 3.2 | [N-]=[N+]=Nc1cc(O)cc(OC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c1 | 10.1021/jm00121a046 | |||
CHEMBL89096 | 213401 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 12 | 5 | 7 | 3.2 | [N-]=[N+]=Nc1cc(O)cc(OC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c1 | 10.1021/jm00121a046 | |||
102305175 | 31662 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 374 | 12 | 4 | 4 | 3.0 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCC[PH](=O)O | 10.1021/jm010264b | |||
CHEMBL134546 | 31662 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 374 | 12 | 4 | 4 | 3.0 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCC[PH](=O)O | 10.1021/jm010264b | |||
15486805 | 172832 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | |||
CHEMBL425681 | 172832 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 394 | 13 | 4 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)COc1ccccc1 | 10.1021/jm990542v | |||
11283 | 7373 | 10 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Mouse | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
1884 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
5280363 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
912 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
CHEMBL815 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
DB12789 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
162671048 | 189586 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4790821 | 189586 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 451 | 5 | 1 | 4 | 5.4 | Cc1c(-c2cccs2)nc2ccc(Br)cc2c1C(=O)NCCc1cccnc1 | 10.1021/acs.jmedchem.0c00834 | |||
10740699 | 66847 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 417 | 13 | 4 | 7 | 3.2 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1nccs1 | 10.1021/jm990542v | |||
CHEMBL173811 | 66847 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 417 | 13 | 4 | 7 | 3.2 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1nccs1 | 10.1021/jm990542v | |||
6441607 | 161858 | 28 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL40183 | 161858 | 28 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 12 | 4 | 4 | 3.7 | CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
44285252 | 127871 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL35715 | 127871 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
44570666 | 190049 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 4.5 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3ccc(F)c(F)c3)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL479664 | 190049 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 522 | 6 | 1 | 4 | 4.5 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3ccc(F)c(F)c3)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
10670992 | 66830 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 444 | 13 | 4 | 5 | 4.4 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(Cl)c1 | 10.1021/jm990542v | |||
CHEMBL173680 | 66830 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 444 | 13 | 4 | 5 | 4.4 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(Cl)c1 | 10.1021/jm990542v | |||
11283 | 7373 | 10 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Mouse | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
44565193 | 183639 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL461390 | 183639 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44564804 | 183479 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL459885 | 183479 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
1894 | 7744 | 41 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | |||
5311053 | 7744 | 41 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | |||
CHEMBL37853 | 7744 | 41 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | |||
DB11507 | 7744 | 41 | None | 1 | 5 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990542v | |||
5311234 | 121917 | 25 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | |||
CHEMBL334398 | 121917 | 25 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 390 | 11 | 4 | 5 | 2.5 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/s0960-894x(00)00273-0 | |||
1955 | 6805 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | |||
5311240 | 6805 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | |||
CHEMBL36041 | 6805 | 1 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.6 | O[C@@H](COc1cccc(c1)Cl)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1CCCCCCC(=O)O)O | 10.1021/jm990542v | |||
44322596 | 171679 | 0 | None | - | 0 | Bovine | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL422242 | 171679 | 0 | None | - | 0 | Bovine | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
44285208 | 106688 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 13 | 4 | 5 | 3.4 | N#Cc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL286132 | 106688 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 417 | 13 | 4 | 5 | 3.4 | N#Cc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
44285328 | 138229 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(F)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL36911 | 138229 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(F)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
44285199 | 106975 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1C(F)(F)F | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL288277 | 106975 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1C(F)(F)F | 10.1016/s0960-894x(00)00273-0 | |||
11283 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
44564990 | 199429 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(F)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL521777 | 199429 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(F)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44322613 | 213270 | 0 | None | - | 0 | Bovine | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL88275 | 213270 | 0 | None | - | 0 | Bovine | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
44564571 | 193594 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL489310 | 193594 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 536 | 6 | 1 | 5 | 6.1 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44190762 | 183659 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | |||
CHEMBL461571 | 183659 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 531 | 8 | 1 | 5 | 6.6 | Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@H](C)C(=O)O)c1 | 10.1016/j.bmcl.2008.07.103 | |||
44571290 | 190021 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 542 | 6 | 1 | 5 | 5.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL479633 | 190021 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 542 | 6 | 1 | 5 | 5.4 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(Cl)c(Cl)s3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
10741197 | 66785 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(F)c1 | 10.1021/jm990542v | |||
CHEMBL173499 | 66785 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 428 | 13 | 4 | 5 | 3.8 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(F)c1 | 10.1021/jm990542v | |||
44285251 | 169308 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL416784 | 169308 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
10251023 | 66735 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 410 | 13 | 4 | 5 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1ccccc1 | 10.1021/jm990542v | |||
CHEMBL173299 | 66735 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 410 | 13 | 4 | 5 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1ccccc1 | 10.1021/jm990542v | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm010264b | |||
10981979 | 123393 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 388 | 12 | 4 | 4 | 3.5 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(C)(=O)O | 10.1021/jm010264b | |||
CHEMBL336781 | 123393 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 388 | 12 | 4 | 4 | 3.5 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(C)(=O)O | 10.1021/jm010264b | |||
44564937 | 186014 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL472754 | 186014 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 538 | 6 | 1 | 5 | 5.7 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(F)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44564841 | 187143 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3F)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL475152 | 187143 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 520 | 6 | 1 | 5 | 5.6 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc(Cl)cc3F)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44322613 | 213270 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL88275 | 213270 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
10648334 | 66459 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 478 | 13 | 4 | 5 | 4.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(C(F)(F)F)c1 | 10.1021/jm990542v | |||
CHEMBL172250 | 66459 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 478 | 13 | 4 | 5 | 4.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CSc1cccc(C(F)(F)F)c1 | 10.1021/jm990542v | |||
44322611 | 213377 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | |||
CHEMBL88974 | 213377 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | |||
5311239 | 137396 | 31 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1021/jm990542v | |||
CHEMBL36817 | 137396 | 31 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1021/jm990542v | |||
44322291 | 213601 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
CHEMBL90450 | 213601 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
44564893 | 187302 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL475349 | 187302 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)cc3Cl)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44157014 | 199396 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 518 | 6 | 1 | 5 | 5.9 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc4ccccc4c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL521609 | 199396 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 518 | 6 | 1 | 5 | 5.9 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)c2c(Oc3ccc4ccccc4c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
44285161 | 107135 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(C(F)(F)F)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL289660 | 107135 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccc(C(F)(F)F)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
25195248 | 189714 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 4.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL479263 | 189714 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 540 | 6 | 1 | 4 | 4.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(F)c(F)c1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
11133176 | 30961 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 402 | 13 | 4 | 4 | 3.9 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CC | 10.1021/jm010264b | |||
CHEMBL133945 | 30961 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 402 | 13 | 4 | 4 | 3.9 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CC | 10.1021/jm010264b | |||
1283333 | 98310 | 7 | None | - | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 8 | 1 | 3 | 4.7 | CCc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1016/j.bmcl.2006.12.060 | |||
CHEMBL240436 | 98310 | 7 | None | - | 2 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 456 | 8 | 1 | 3 | 4.7 | CCc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 | 10.1016/j.bmcl.2006.12.060 | |||
10001608 | 107125 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL289568 | 107125 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
9888589 | 175900 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.0 | CP(=O)(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | |||
CHEMBL440164 | 175900 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.0 | CP(=O)(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1021/jm010264b | |||
44571352 | 190813 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 504 | 6 | 1 | 4 | 4.3 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)cc(F)c3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL482158 | 190813 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 504 | 6 | 1 | 4 | 4.3 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)cc(F)c3)=C1N(Cc1ccc(F)cc1)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm00121a046 | |||
44285145 | 107222 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL290571 | 107222 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)cc1 | 10.1016/s0960-894x(00)00273-0 | |||
44564892 | 187301 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
CHEMBL475348 | 187301 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 554 | 6 | 1 | 5 | 6.2 | Cn1cc(/C=C/C(=O)NS(=O)(=O)c2cc(F)c(F)cc2F)c2c(Oc3ccc(Cl)c(Cl)c3)cccc21 | 10.1016/j.bmcl.2008.12.112 | |||
71458087 | 86338 | 0 | None | - | 0 | Bovine | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL2114229 | 86338 | 0 | None | - | 0 | Bovine | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 430 | 13 | 3 | 5 | 4.0 | COC(=O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
11283 | 7373 | 10 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
5311239 | 137396 | 31 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL36817 | 137396 | 31 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 358 | 14 | 4 | 4 | 3.5 | CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
44285209 | 138171 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 14 | 4 | 4 | 4.1 | CCc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL36901 | 138171 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 14 | 4 | 4 | 4.1 | CCc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1016/s0960-894x(00)00273-0 | |||
15486806 | 107263 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1021/jm990542v | |||
CHEMBL290969 | 107263 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1021/jm990542v | |||
44285270 | 159670 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL39746 | 159670 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 422 | 14 | 4 | 5 | 3.6 | COc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
46879894 | 12953 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 6 | 1 | 5 | 7.2 | Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(-c3cc(NS(=O)(=O)c4ccc(F)c(F)c4)no3)cc(F)cc12 | 10.1016/j.bmcl.2009.09.084 | |||
CHEMBL1081186 | 12953 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 565 | 6 | 1 | 5 | 7.2 | Cc1cn(Cc2ccc(Cl)cc2Cl)c2c(-c3cc(NS(=O)(=O)c4ccc(F)c(F)c4)no3)cc(F)cc12 | 10.1016/j.bmcl.2009.09.084 | |||
44571291 | 196935 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 554 | 7 | 1 | 6 | 5.3 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL517377 | 196935 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 554 | 7 | 1 | 6 | 5.3 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4cc(Cl)c(Cl)s4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | |||
44322588 | 113813 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 445 | 12 | 5 | 6 | 3.7 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c(O)c1 | 10.1021/jm00121a046 | |||
CHEMBL315519 | 113813 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 445 | 12 | 5 | 6 | 3.7 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)c(O)c1 | 10.1021/jm00121a046 | |||
10741017 | 68062 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 424 | 13 | 4 | 5 | 4.0 | Cc1cccc(SCC(O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1021/jm990542v | |||
CHEMBL176692 | 68062 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 424 | 13 | 4 | 5 | 4.0 | Cc1cccc(SCC(O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(=O)O)c1 | 10.1021/jm990542v | |||
44285146 | 142011 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL37244 | 142011 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 406 | 13 | 4 | 4 | 3.9 | Cc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O | 10.1016/s0960-894x(00)00273-0 | |||
44571354 | 190848 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 516 | 7 | 1 | 5 | 4.2 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4ccc(F)c(F)c4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL482330 | 190848 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 516 | 7 | 1 | 5 | 4.2 | COc1cccc(CN2C(=O)CC3(C)CCCC(/C=C/C(=O)NS(=O)(=O)c4ccc(F)c(F)c4)=C23)c1 | 10.1016/j.bmcl.2008.12.027 | |||
71450954 | 86339 | 0 | None | - | 0 | Bovine | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL2114230 | 86339 | 0 | None | - | 0 | Bovine | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
11133782 | 30925 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 15 | 4 | 4 | 4.6 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CCCC | 10.1021/jm010264b | |||
CHEMBL133910 | 30925 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 430 | 15 | 4 | 4 | 4.6 | CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCP(=O)(O)CCCC | 10.1021/jm010264b | |||
71449156 | 86336 | 0 | None | - | 0 | Bovine | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
CHEMBL2114224 | 86336 | 0 | None | - | 0 | Bovine | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990542v | |||
44322611 | 213377 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | |||
CHEMBL88974 | 213377 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 429 | 12 | 4 | 5 | 4.0 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1 | 10.1021/jm00121a046 | |||
44322291 | 213601 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
CHEMBL90450 | 213601 | 0 | None | - | 0 | Bovine | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 555 | 12 | 4 | 5 | 4.6 | [N-]=[N+]=Nc1ccc(CC[C@H](O)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)cc1I | 10.1021/jm00121a046 | |||
71450954 | 86339 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
CHEMBL2114230 | 86339 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 416 | 13 | 4 | 4 | 3.9 | O=C(O)CCC/C=C\C[C@@H]1C(/C=C/[C@H](O)CCCCc2ccccc2)[C@H](O)C[C@@H]1O | 10.1021/jm00121a046 | |||
44570668 | 190796 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1cccc(Cl)c1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL482018 | 190796 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1cccc(Cl)c1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
9909510 | 107095 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1F | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL289373 | 107095 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 13 | 4 | 4 | 3.7 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1F | 10.1016/s0960-894x(00)00273-0 | |||
44570712 | 189857 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(Cl)cc1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
CHEMBL479439 | 189857 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 572 | 6 | 1 | 4 | 5.6 | CC12CCCC(/C=C/C(=O)NS(=O)(=O)c3cc(F)c(F)cc3F)=C1N(Cc1ccc(Cl)cc1Cl)C(=O)C2 | 10.1016/j.bmcl.2008.12.027 | |||
10389527 | 160124 | 19 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL39784 | 160124 | 19 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
10389527 | 160124 | 19 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL39784 | 160124 | 19 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 460 | 13 | 4 | 4 | 4.6 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/s0960-894x(00)00273-0 | |||
15486806 | 107263 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/s0960-894x(00)00273-0 | |||
CHEMBL290969 | 107263 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 392 | 13 | 4 | 4 | 3.5 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/s0960-894x(00)00273-0 | |||
10739351 | 175095 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 13 | 5 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CNc1ccccc1 | 10.1021/jm990542v | |||
CHEMBL434173 | 175095 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 393 | 13 | 5 | 5 | 3.0 | O=C(O)CCCCCC[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CCC(O)CNc1ccccc1 | 10.1021/jm990542v | |||
122522051 | 159792 | 14 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 4.3 | CC(C)[C@H](N)C(=O)OCC[C@H](NC(=O)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 | nan | |||
CHEMBL3975522 | 159792 | 14 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 599 | 11 | 2 | 7 | 4.3 | CC(C)[C@H](N)C(=O)OCC[C@H](NC(=O)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 | nan | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1021/jm990587w | |||
44564518 | 199948 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL523143 | 199948 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | |||
53358922 | 71204 | 0 | None | -229 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813276 | 71204 | 0 | None | -229 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 522 | 6 | 1 | 6 | 5.3 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl | 10.1016/j.bmc.2011.06.014 | |||
1884 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | |||
5280363 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | |||
912 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL815 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | |||
DB12789 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmcl.2004.06.037 | |||
1884 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | |||
5280363 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | |||
912 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL815 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | |||
DB12789 | 9857 | 52 | None | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10.1016/j.bmc.2008.11.070 | |||
44564468 | 199486 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL521964 | 199486 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | |||
9895436 | 113793 | 0 | None | -72 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | |||
CHEMBL315391 | 113793 | 0 | None | -72 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 628 | 8 | 1 | 4 | 7.4 | CC(C)(Cc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | |||
44564520 | 193568 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL489109 | 193568 | 0 | None | - | 1 | Bovine | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | |||
53358921 | 71215 | 0 | None | -295 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813287 | 71215 | 0 | None | -295 | 6 | Mouse | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 1 | 5 | 5.4 | CCN1c2ccccc2C[C@@H]1COc1ccc(C(=O)n2c(C)c(CC(=O)O)c3ccccc32)c(C)c1 | 10.1016/j.bmc.2011.06.014 | |||
11597294 | 172955 | 4 | None | -16982 | 8 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | |||
CHEMBL426387 | 172955 | 4 | None | -16982 | 8 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 435 | 4 | 1 | 2 | 5.7 | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 | 10.1021/jm0603668 | |||
44393448 | 72354 | 0 | None | - | 1 | Bovine | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL183193 | 72354 | 0 | None | - | 1 | Bovine | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
11283 | 7373 | 10 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
146368333 | 7373 | 10 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 10.1021/acs.jmedchem.0c00834 | |||
10277744 | 71186 | 0 | None | -60 | 7 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813116 | 71186 | 0 | None | -60 | 7 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
10228100 | 71188 | 0 | None | -295 | 5 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813118 | 71188 | 0 | None | -295 | 5 | Mouse | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 488 | 6 | 1 | 6 | 4.7 | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
10181606 | 213130 | 0 | None | -676 | 7 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | |||
CHEMBL87371 | 213130 | 0 | None | -676 | 7 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 437 | 5 | 1 | 4 | 5.2 | O=C(/C=C/c1ccccc1-c1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1cccs1 | 10.1016/s0960-894x(02)00518-8 | |||
10551015 | 116889 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | |||
CHEMBL323591 | 116889 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | |||
15948325 | 9304 | 45 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | |||
5856 | 9304 | 45 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | |||
CHEMBL402162 | 9304 | 45 | None | -1621 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 603 | 11 | 1 | 8 | 4.7 | CCOc1c2CN(C(=O)c2c(c2c1nccc2)OCC)c1ccc(cc1C)CS(=O)(=O)NC(=O)Cc1ccccc1OC | 10.1016/j.bmcl.2008.01.103 | |||
10116116 | 71185 | 0 | None | -269 | 5 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813115 | 71185 | 0 | None | -269 | 5 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1c(CC(=O)O)c2ccccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
11476788 | 168053 | 0 | None | -147 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | |||
CHEMBL412070 | 168053 | 0 | None | -147 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 463 | 5 | 1 | 5 | 4.4 | CS(=O)(=O)c1cc(F)cc2c1c(C(=O)c1ccc(Cl)cc1)c1n2CCC[C@@H]1CC(=O)O | 10.1016/j.bmcl.2008.03.015 | |||
10185612 | 71187 | 0 | None | -75 | 4 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813117 | 71187 | 0 | None | -75 | 4 | Mouse | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 504 | 6 | 1 | 6 | 5.2 | Cc1c(CC(=O)O)c2cc(Cl)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
11743212 | 23936 | 0 | None | -7244 | 7 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | |||
CHEMBL125588 | 23936 | 0 | None | -7244 | 7 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 426 | 7 | 1 | 3 | 6.8 | O=C(O)C1CC1c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 | 10.1016/s0960-894x(03)00794-7 | |||
24765153 | 191308 | 0 | None | -39810 | 8 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
CHEMBL484778 | 191308 | 0 | None | -39810 | 8 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 434 | 5 | 1 | 4 | 6.6 | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O | 10.1016/j.bmcl.2009.03.010 | |||
10299717 | 71191 | 0 | None | -758 | 6 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL1813120 | 71191 | 0 | None | -758 | 6 | Mouse | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 6 | 1 | 6 | 4.9 | Cc1cc(OC[C@@H]2CN(C)c3ccccc3O2)ccc1C(=O)n1c(C)c(CC(=O)O)c2ccccc21 | 10.1016/j.bmc.2011.06.014 | |||
44393607 | 104880 | 0 | None | - | 1 | Bovine | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL273444 | 104880 | 0 | None | - | 1 | Bovine | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
1894 | 7744 | 41 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | |||
5311053 | 7744 | 41 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | |||
CHEMBL37853 | 7744 | 41 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | |||
DB11507 | 7744 | 41 | None | 1 | 5 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10.1021/jm990587w | |||
44393462 | 73621 | 0 | None | - | 1 | Bovine | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL186192 | 73621 | 0 | None | - | 1 | Bovine | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
10116114 | 132664 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
CHEMBL364841 | 132664 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.06.014 | |||
10116114 | 132664 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | |||
CHEMBL364841 | 132664 | 0 | None | -891 | 8 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 470 | 6 | 1 | 6 | 4.5 | Cc1cc2c(CC(=O)O)cccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1 | 10.1016/j.bmc.2011.08.007 | |||
44393420 | 72934 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL184249 | 72934 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
15947857 | 162292 | 7 | None | -301 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | |||
CHEMBL404199 | 162292 | 7 | None | -301 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 767 | 12 | 1 | 9 | 6.3 | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 | 10.1016/j.bmcl.2008.01.103 | |||
44393431 | 73481 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL185559 | 73481 | 0 | None | - | 1 | Bovine | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
9939791 | 168697 | 0 | None | -316 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | |||
CHEMBL415310 | 168697 | 0 | None | -316 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 684 | 8 | 1 | 5 | 7.2 | CO[C@](C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)(c1ccccc1)C(F)(F)F | 10.1016/s0960-894x(99)00465-5 | |||
11488860 | 26063 | 0 | None | -9999 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | |||
CHEMBL1290413 | 26063 | 0 | None | -9999 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 497 | 5 | 1 | 4 | 5.7 | C[C@@H](c1ccc(C(F)(F)F)cc1)n1c2c(c3cc(F)cc(S(C)(=O)=O)c31)CCC[C@@H]2CC(=O)O | 10.1016/j.bmcl.2010.10.018 | |||
9809136 | 113666 | 0 | None | -501 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | |||
CHEMBL314533 | 113666 | 0 | None | -501 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 614 | 7 | 1 | 4 | 7.1 | CC(C)(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | |||
44393422 | 131183 | 0 | None | - | 1 | Bovine | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL363946 | 131183 | 0 | None | - | 1 | Bovine | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
6438324 | 73465 | 2 | None | - | 1 | Bovine | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL185484 | 73465 | 2 | None | - | 1 | Bovine | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/C(O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
9938626 | 213612 | 0 | None | -331 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | |||
CHEMBL90491 | 213612 | 0 | None | -331 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 600 | 7 | 1 | 4 | 6.9 | CC(C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1)c1ccccc1 | 10.1016/s0960-894x(99)00465-5 | |||
10717894 | 173771 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | |||
CHEMBL428794 | 173771 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 11 | 4 | 5 | 3.6 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)CC[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1021/jm990587w | |||
10217804 | 157621 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 8 | 2 | 5 | 3.8 | O=C(N[C@@H](CCO)c1ccc(F)cc1)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1 | nan | |||
CHEMBL3957115 | 157621 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 500 | 8 | 2 | 5 | 3.8 | O=C(N[C@@H](CCO)c1ccc(F)cc1)[C@@H]1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1 | nan | |||
9874010 | 213969 | 0 | None | -363 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | |||
CHEMBL92539 | 213969 | 0 | None | -363 | 8 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 629 | 8 | 1 | 4 | 6.9 | CN(CCc1ccccc1)C(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2C(=O)c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(99)00465-5 | |||
44393601 | 71634 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL182117 | 71634 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 390 | 12 | 3 | 5 | 3.0 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
25003075 | 13610 | 18 | None | -22908 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
CHEMBL1084009 | 13610 | 18 | None | -22908 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 478 | 6 | 2 | 3 | 5.8 | O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1 | 10.1016/j.bmcl.2010.04.065 | |||
44393474 | 129771 | 0 | None | - | 1 | Bovine | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL360869 | 129771 | 0 | None | - | 1 | Bovine | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 340 | 12 | 3 | 4 | 3.1 | CCCCC[C@H](O)/C=C/[C@H]1OC[C@H](O)[C@@H]1C/C=C\CCCC(=O)O | 10.1016/j.bmcl.2004.06.037 | |||
9845493 | 193884 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL491474 | 193884 | 0 | None | - | 1 | Bovine | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 428 | 12 | 4 | 6 | 2.4 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmc.2008.11.070 | |||
9868867 | 193901 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL491667 | 193901 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 460 | 12 | 4 | 5 | 3.3 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@@H](O)CCc1cccc(C(F)(F)F)c1 | 10.1016/j.bmc.2008.11.070 | |||
44393438 | 72938 | 0 | None | - | 1 | Bovine | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL184264 | 72938 | 0 | None | - | 1 | Bovine | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
44393451 | 175029 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL433752 | 175029 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
44564519 | 193885 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL491475 | 193885 | 0 | None | - | 1 | Bovine | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 12 | 4 | 6 | 1.8 | O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1OC[C@H](O)COc1ccccc1 | 10.1016/j.bmc.2008.11.070 | |||
44393436 | 129762 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL360862 | 129762 | 0 | None | - | 1 | Bovine | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 424 | 12 | 3 | 5 | 3.6 | O=C(O)CCCC/C=C\C[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@@H](O)COc1cccc(Cl)c1 | 10.1016/j.bmcl.2004.06.037 | |||
5282380 | 131821 | 41 | None | - | 1 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL364375 | 131821 | 41 | None | - | 1 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCC/C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 | 10.1016/j.bmcl.2004.06.037 | |||
1960 | 9065 | 42 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | |||
6441636 | 9065 | 42 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | |||
CHEMBL1050 | 9065 | 42 | None | -38 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10.1016/j.bmc.2008.11.070 | |||
44393457 | 130997 | 0 | None | - | 1 | Bovine | 5.0 | pKi | = | 5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
CHEMBL363439 | 130997 | 0 | None | - | 1 | Bovine | 5.0 | pKi | = | 5 | Binding | ChEMBL | 458 | 12 | 3 | 5 | 4.0 | O=C(O)CC/C=C\CCC[C@H]1[C@@H](O)CO[C@@H]1/C=C/[C@H](O)COc1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2004.06.037 | |||
3356 | 9060 | 73 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | |||
4326 | 9060 | 73 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | |||
9867642 | 9060 | 73 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | |||
CHEMBL426559 | 9060 | 73 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | |||
DB11629 | 9060 | 73 | None | -398 | 8 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | 10.1021/jm0603668 | |||
11283 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | |||
146368333 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | |||
CHEMBL4643852 | 7373 | 10 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Binding | Guide to Pharmacology | 543 | 8 | 2 | 4 | 5.9 | OC(=O)CC[C@H](c1ccccc1Cl)CNC(=O)c1c(C)c(nc2c1cc(Br)cc2)N1CCCC1 | 32969660 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
67861203 | 222844 | 0 | 3H-PGF2Alpha | 9 | 8 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 424 | 11 | 4 | 5 | 3.2 | C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O | None | |||
1940 | 8444 | 41 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
3417 | 8444 | 41 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
5311100 | 8444 | 41 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
CHEMBL1201379 | 8444 | 41 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
DB11519 | 8444 | 41 | 3H-PGF2Alpha | -41 | 10 | Bovine | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
1883 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1916 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
5280360 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
913 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
CHEMBL548 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
DB00917 | 9856 | 75 | 3H-PGF2Alpha | -41 | 24 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
None | 222828 | 0 | 3H-PGF2Alpha | -1 | 3 | Mouse | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 512 | 11 | 2 | 4 | 4.6 | C1CC2C(C(C1O2)CC=CCCCC(=O)O)C=CC(COC3=CC=C(C=C3)I)O | None | |||
1888 | 10672 | 29 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
1974 | 10672 | 29 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
5311493 | 10672 | 29 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
CHEMBL521784 | 10672 | 29 | 3H-PGF2Alpha | -39 | 17 | Mouse | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
91798918 | 222842 | 0 | 3H-PGF2Alpha | -147 | 10 | Bovine | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
119461 | 7108 | 72 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
1896 | 7108 | 72 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
CHEMBL1317823 | 7108 | 72 | 3H-PGF2Alpha | -30 | 10 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 1 | 4 | 3.4 | CC(Oc1ccc2c(c1)oc1c(c2=O)cc(cc1)C(=O)O)C | None | |||
119304 | 7539 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
1878 | 7539 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
40481312 | 7539 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
CHEMBL575504 | 7539 | 0 | 3H-PGF2Alpha | -14125 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
122021 | 7543 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | |||
1897 | 7543 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | |||
1899 | 7543 | 0 | 3H-PGF2Alpha | -7585 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 459 | 13 | 3 | 5 | 3.7 | OC(=O)CCCCCCC1N(NCC(C2CCCCC2)O)C(=O)N(C1=O)Cc1ccccc1 | None | |||
1817 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1936 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
5282381 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
CHEMBL606 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
DB00929 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
138 | 9855 | 88 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | |||
1882 | 9855 | 88 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | |||
5280723 | 9855 | 88 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | |||
CHEMBL495 | 9855 | 88 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | |||
DB00770 | 9855 | 88 | 3H-PGF2Alpha | -10000 | 18 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 354 | 13 | 3 | 4 | 3.5 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O)O | None | |||
1980 | 10434 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | |||
1985 | 10434 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | |||
6437074 | 10434 | 0 | 3H-PGF2Alpha | -10000 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 387 | 10 | 4 | 4 | 3.3 | O=C(Nc1ccccc1)NNC[C@@H]1[C@@H]2CC[C@H]([C@@H]1C/C=C\CCCC(=O)O)O2 | None | |||
5311035 | 104579 | 29 | 3H-PGF2Alpha | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | |||
CHEMBL271896 | 104579 | 29 | 3H-PGF2Alpha | -91 | 9 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 408 | 13 | 2 | 5 | 4.3 | CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1 | None | |||
133126726 | 222824 | 0 | 3H-PGF2Alpha | -954 | 14 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
24868263 | 222824 | 0 | 3H-PGF2Alpha | -954 | 14 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
None | 222830 | 0 | 3H-PGF2Alpha | -5248 | 4 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 587 | 15 | 3 | 8 | 4.7 | C1C(C(C(C1=O)CCC=CCCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)OCC(COC4=CC=CC=C4)O)O | None | |||
None | 222846 | 0 | 3H-PGF2Alpha | -1 | 2 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 400 | 9 | 3 | 4 | 3.4 | CC1CCCCC1C(C=CC2C(CC(C2CC=CCOCC(=O)O)Cl)O)O | None | |||
None | 222849 | 0 | 3H-PGF2Alpha | 1 | 2 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 150 | 1 | 0 | 4 | 1.3 | C1N(CSCS1)N=O | None | |||
132748 | 223191 | 0 | 3H-PGF2Alpha | -7 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 3 | 2 | 4 | 4.6 | C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CCC4=CC=NC=C4)C=C(C=C3)Cl.Cl | None | |||
None | 223193 | 0 | 3H-PGF2Alpha | -10 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 477 | 11 | 1 | 5 | 5.1 | C1CC(=O)CC1CCC(=CCC(C(=O)O)N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4 | None | |||
1883 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1916 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
5280360 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
913 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
CHEMBL548 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
DB00917 | 9856 | 75 | 3H-PGF2Alpha | -57 | 24 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1884 | 9857 | 52 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | 3H-PGF2Alpha | -14 | 22 | Bovine | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
133126726 | 222824 | 0 | 3H-PGF2Alpha | -114 | 14 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
24868263 | 222824 | 0 | 3H-PGF2Alpha | -114 | 14 | Mouse | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
1913 | 9242 | 0 | 3H-PGF2Alpha | -870 | 15 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
5311223 | 9242 | 0 | 3H-PGF2Alpha | -870 | 15 | Mouse | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
1917 | 7714 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
5311044 | 7714 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
631 | 7714 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
CHEMBL160629 | 7714 | 0 | 3H-PGF2Alpha | -9 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
None | 223192 | 0 | 3H-PGF2Alpha | -5495 | 6 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 384 | 9 | 3 | 3 | 4.3 | C1CCC(CC1)C(C=CC2C(CC(C2CC=CCCCC(=O)O)Cl)O)O | None | |||
119304 | 7539 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
1878 | 7539 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
40481312 | 7539 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
CHEMBL575504 | 7539 | 0 | 3H-PGF2Alpha | -2398 | 9 | Mouse | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 368 | 11 | 3 | 4 | 2.7 | OC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C1CCCCC1)O | None | |||
134689669 | 222829 | 0 | 3H-PGF2Alpha | -19 | 12 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
1940 | 8444 | 41 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
3417 | 8444 | 41 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
5311100 | 8444 | 41 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
CHEMBL1201379 | 8444 | 41 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
DB11519 | 8444 | 41 | 3H-PGF2Alpha | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
1551 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1961 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
5311221 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
CHEMBL1051 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
DB00654 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1888 | 10672 | 29 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
1974 | 10672 | 29 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
5311493 | 10672 | 29 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
CHEMBL521784 | 10672 | 29 | 3H-PGF2Alpha | -9 | 17 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
1881 | 9853 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1891 | 9853 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
448457 | 9853 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL1235252 | 9853 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB02056 | 9853 | 0 | 3H-PGF2Alpha | -1148 | 21 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
134689669 | 222829 | 0 | 3H-PGF2Alpha | -1380 | 12 | Bovine | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
1884 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1884 | 9857 | 52 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | 3H-PGF2Alpha | 4 | 22 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1940 | 8444 | 41 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
3417 | 8444 | 41 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
5311100 | 8444 | 41 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
CHEMBL1201379 | 8444 | 41 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
DB11519 | 8444 | 41 | 3H-PGF2Alpha | -1 | 10 | Mouse | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | None | |||
67861203 | 222844 | 0 | 3H-PGF2Alpha | -66 | 8 | Bovine | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 424 | 11 | 4 | 5 | 3.2 | C1C(C(C(C1O)C=CC(COC2=CC(=CC=C2)Cl)O)CC=CCCCC(=O)O)O | None | |||
1883 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1916 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
5280360 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
913 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
CHEMBL548 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
DB00917 | 9856 | 75 | 3H-PGF2Alpha | -3388 | 24 | Bovine | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
None | 222850 | 0 | 3H-PGF2Alpha | 2 | 2 | Bovine | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | CC(C)OC(=O)CCCC=CCC1C(CC(C1CCC(CCC2=CC=CC=C2)O)O)O | None | |||
133126726 | 222824 | 0 | 3H-PGF2Alpha | -40 | 14 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
24868263 | 222824 | 0 | 3H-PGF2Alpha | -40 | 14 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 350 | 10 | 3 | 3 | 4.1 | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
1881 | 9853 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1891 | 9853 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
448457 | 9853 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL1235252 | 9853 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB02056 | 9853 | 0 | 3H-PGF2Alpha | -22 | 21 | Mouse | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1884 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | 3H-PGF2Alpha | -4 | 22 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
3356 | 9060 | 73 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | |||
4326 | 9060 | 73 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | |||
9867642 | 9060 | 73 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | |||
CHEMBL426559 | 9060 | 73 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | |||
DB11629 | 9060 | 73 | None | -398 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 435 | 5 | 1 | 4 | 4.4 | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F | None | |||
1958 | 7445 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | |||
371 | 7445 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | |||
5311027 | 7445 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | |||
CHEMBL1200963 | 7445 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | |||
DB00905 | 7445 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 415 | 12 | 4 | 4 | 3.1 | CCNC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](CCc1ccccc1)O)O | None | |||
1913 | 9242 | 0 | 3H-PGF2Alpha | -3630 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
5311223 | 9242 | 0 | 3H-PGF2Alpha | -3630 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | None | |||
1551 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1961 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
5311221 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
CHEMBL1051 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
DB00654 | 9066 | 0 | 3H-PGF2Alpha | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
134689669 | 222829 | 0 | 3H-PGF2Alpha | -316 | 12 | Mouse | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
None | 222847 | 0 | 3H-PGF2Alpha | 1 | 2 | Bovine | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 424 | 16 | 2 | 5 | 5.1 | CCCCCCCC(=O)CCC1C(CC(C1CC=CCCCC(=O)OC(C)C)O)O | None | |||
138107701 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | |||
5311181 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | |||
CHEMBL494 | 194243 | 46 | None | -6 | 15 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)C[C@H]2C[C@H]1O | None | |||
1551 | 9066 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1961 | 9066 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
5311221 | 9066 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
CHEMBL1051 | 9066 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
DB00654 | 9066 | 0 | None | -6 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
134689669 | 222829 | 0 | None | -19 | 12 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 465 | 12 | 3 | 7 | 1.7 | CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
1881 | 9853 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1891 | 9853 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
448457 | 9853 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL1235252 | 9853 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB02056 | 9853 | 0 | 3H-PGF2Alpha | -5 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1884 | 9857 | 52 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
5280363 | 9857 | 52 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
912 | 9857 | 52 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
CHEMBL815 | 9857 | 52 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
DB12789 | 9857 | 52 | None | -14 | 22 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | None | |||
1883 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1916 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
5280360 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
913 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
CHEMBL548 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
DB00917 | 9856 | 75 | None | -57 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
89077401 | 222823 | 0 | 3H-PGF2Alpha | -56 | 12 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 360 | 8 | 3 | 3 | 3.5 | CC#CCC(C)C(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O | None | |||
1883 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
1916 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
5280360 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
913 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
CHEMBL548 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
DB00917 | 9856 | 75 | None | -41 | 24 | Mouse | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | None | |||
11156438 | 9064 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
5261 | 9064 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
9635 | 9064 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
CHEMBL2364612 | 9064 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
DB11660 | 9064 | 0 | None | -1 | 2 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
1551 | 9066 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
1961 | 9066 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
5311221 | 9066 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
CHEMBL1051 | 9066 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
DB00654 | 9066 | 0 | None | 6 | 7 | Bovine | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | None | |||
91798918 | 222842 | 0 | None | -3 | 10 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
5282226 | 224508 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 500 | 12 | 3 | 6 | 4.4 | CC(C)OC(=O)CCC\C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1\C=C\[C@@H](O)COC1=CC(=CC=C1)C(F)(F)F | None | |||
91798918 | 222842 | 0 | 3H-PGF2Alpha | -3 | 10 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O | None | |||
1888 | 10672 | 29 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
1974 | 10672 | 29 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
5311493 | 10672 | 29 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
CHEMBL521784 | 10672 | 29 | 3H-PGF2Alpha | -354 | 17 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | None | |||
1817 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1936 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
5282381 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
CHEMBL606 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
DB00929 | 9320 | 68 | 3H-PGF2Alpha | -20 | 12 | Human | 5.0 | pKi | = | 5.0 | Binding | PDSP KiDatabase | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
None | 222822 | 0 | 3H-PGF2Alpha | -4 | 5 | Mouse | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 366 | 12 | 2 | 3 | 5.2 | CCCCCC(C=CC1CC2CC(C1CC=CCCCC(=O)O)S2)O | None | |||
None | 222845 | 0 | 3H-PGF2Alpha | 91 | 2 | Bovine | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 390 | 12 | 4 | 4 | 3.3 | C1C(C(C(C1O)CC=CCCCC(=O)O)CCC(CCC2=CC=CC=C2)O)O | None | |||
1551 | 9066 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | |||
1961 | 9066 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | |||
5311221 | 9066 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | |||
CHEMBL1051 | 9066 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | |||
DB00654 | 9066 | 0 | None | -6 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | Guide to Pharmacology | 432 | 13 | 3 | 5 | 4.2 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC(C)C)O | 10634944 | |||
10152528 | 7274 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 515 | 7 | 1 | 5 | 4.7 | O=C([C@@H]1SCCN1S(=O)(=O)c1ccc(cc1)c1ccccc1)N[C@@H](c1ccccn1)c1ccccc1 | 17618756 | |||
3424 | 7274 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 515 | 7 | 1 | 5 | 4.7 | O=C([C@@H]1SCCN1S(=O)(=O)c1ccc(cc1)c1ccccc1)N[C@@H](c1ccccn1)c1ccccc1 | 17618756 | |||
50902259 | 9713 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | |||
9875 | 9713 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | |||
CHEMBL4297633 | 9713 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | |||
DB12043 | 9713 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | Guide to Pharmacology | 482 | 10 | 2 | 6 | 4.2 | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C | 25788650 | |||
1940 | 8444 | 41 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | |||
3417 | 8444 | 41 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | |||
5311100 | 8444 | 41 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | |||
CHEMBL1201379 | 8444 | 41 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | |||
DB11519 | 8444 | 41 | None | 1 | 10 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 10634944 | |||
1960 | 9065 | 42 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
6441636 | 9065 | 42 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
CHEMBL1050 | 9065 | 42 | None | 38 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 390 | 12 | 4 | 4 | 3.3 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
1817 | 9320 | 68 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1936 | 9320 | 68 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
5282381 | 9320 | 68 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
CHEMBL606 | 9320 | 68 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
DB00929 | 9320 | 68 | None | -20 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 382 | 13 | 2 | 5 | 4.0 | CCCCC(C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C | None | |||
1917 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
5311044 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
631 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
CHEMBL160629 | 7714 | 0 | None | -9 | 9 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 374 | 6 | 3 | 4 | 2.2 | CCC#CC[C@@H]([C@@H](C#C[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)C | None | |||
1907 | 9043 | 22 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
44403763 | 9043 | 22 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
CHEMBL370606 | 9043 | 22 | None | -12589 | 2 | Human | 5.0 | pKi | None | 5 | Binding | Guide to Pharmacology | 375 | 4 | 1 | 3 | 5.5 | OC(=O)C[C@@H]1CCn2c1c(Sc1ccc(cc1)Cl)c1c2cc(cc1)F | 15755909 | |||
1893 | 7582 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | |||
5311242 | 7582 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | |||
CHEMBL148319 | 7582 | 0 | None | -89 | 13 | Mouse | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 9313928 | |||
1888 | 10672 | 29 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | |||
1974 | 10672 | 29 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | |||
5311493 | 10672 | 29 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | |||
CHEMBL521784 | 10672 | 29 | None | -39 | 17 | Mouse | 6.0 | pKi | None | 6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 9313928 | |||
1895 | 8788 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | |||
6435378 | 8788 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | |||
CHEMBL236025 | 8788 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | |||
DB01088 | 8788 | 0 | None | -63 | 16 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 360 | 8 | 3 | 3 | 3.5 | CC#CCC([C@@H](/C=C/C1[C@H](O)C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)C | 10634944 | |||
1913 | 9242 | 0 | None | -3630 | 15 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | |||
5311223 | 9242 | 0 | None | -3630 | 15 | Human | 6.3 | pKi | None | 6.3 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 10634944 | |||
1893 | 7582 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | |||
5311242 | 7582 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | |||
CHEMBL148319 | 7582 | 0 | None | -25 | 13 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 350 | 10 | 3 | 3 | 4.1 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@H]2[C@@H]1C/C(=C\CCCC(=O)O)/C2)O | 10634944 | |||
1888 | 10672 | 29 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | |||
1974 | 10672 | 29 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | |||
5311493 | 10672 | 29 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | |||
CHEMBL521784 | 10672 | 29 | None | -9 | 17 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 350 | 12 | 2 | 3 | 4.3 | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O | 10634944 | |||
1883 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
1883 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
1916 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
1916 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
5280360 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
5280360 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
913 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
913 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
CHEMBL548 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
CHEMBL548 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
DB00917 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 10634944 | |||
DB00917 | 9856 | 75 | None | -57 | 24 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 12519077 | |||
1919 | 10476 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
2538 | 10476 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
5312153 | 10476 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
CHEMBL1472830 | 10476 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
DB12708 | 10476 | 0 | None | -575 | 7 | Human | 6.7 | pKi | None | 6.7 | Binding | Guide to Pharmacology | 465 | 12 | 3 | 7 | 1.7 | O=C(NS(=O)(=O)C)CCC/C=C\C[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
1913 | 9242 | 0 | None | -870 | 15 | Mouse | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 9313928 | |||
5311223 | 9242 | 0 | None | -870 | 15 | Mouse | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 374 | 12 | 2 | 4 | 4.0 | OC(=O)CCCCCC[C@@H]1[C@@H](/C=C/[C@H](COc2ccccc2)O)CCC1=O | 9313928 | |||
1938 | 8750 | 18 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | |||
5311175 | 8750 | 18 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | |||
CHEMBL2113346 | 8750 | 18 | None | -199 | 4 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 512 | 11 | 2 | 4 | 4.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H]2CC[C@H]([C@@H]1/C=C/[C@H](COc1ccc(cc1)I)O)O2 | 9313928 | |||
1883 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
1916 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
5280360 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
913 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
CHEMBL548 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
DB00917 | 9856 | 75 | None | -41 | 24 | Mouse | 7.0 | pKi | None | 7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O | 9313928 | |||
1918 | 8348 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
5311225 | 8348 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
CHEMBL2104194 | 8348 | 0 | None | -6 | 6 | Human | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 400 | 10 | 2 | 6 | 2.6 | COC(=O)CCC=C=CC[C@H]1C(=O)C[C@H]([C@@H]1/C=C/[C@H](COc1ccccc1)O)O | 10634944 | |||
1881 | 9853 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
1891 | 9853 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
448457 | 9853 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
CHEMBL1235252 | 9853 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
DB02056 | 9853 | 0 | None | -22 | 21 | Mouse | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
1881 | 9853 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
1891 | 9853 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
448457 | 9853 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
CHEMBL1235252 | 9853 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
DB02056 | 9853 | 0 | None | -5 | 21 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 352 | 12 | 3 | 4 | 3.3 | CCCCC[C@@H](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
1884 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
5280363 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
912 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
CHEMBL815 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 10634944 | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 12519077 | |||
DB12789 | 9857 | 52 | None | -4 | 22 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 16604093 | |||
1940 | 8444 | 41 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | |||
3417 | 8444 | 41 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | |||
5311100 | 8444 | 41 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | |||
CHEMBL1201379 | 8444 | 41 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | |||
DB11519 | 8444 | 41 | None | -1 | 10 | Mouse | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 458 | 11 | 4 | 5 | 3.6 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)C(F)(F)F)O)O | 9313928 | |||
1884 | 9857 | 52 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
5280363 | 9857 | 52 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
912 | 9857 | 52 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
CHEMBL815 | 9857 | 52 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
DB12789 | 9857 | 52 | None | 4 | 22 | Mouse | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 354 | 12 | 4 | 4 | 3.0 | CCCCC[C@@H](/C=C/[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O | 9313928 | |||
1894 | 7744 | 41 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | |||
5311053 | 7744 | 41 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | |||
CHEMBL37853 | 7744 | 41 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | |||
DB11507 | 7744 | 41 | None | 1 | 5 | Human | 9.3 | pKi | None | 9.3 | Binding | Guide to Pharmacology | 424 | 11 | 4 | 5 | 3.2 | OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@H]([C@@H]1/C=C/[C@H](COc1cccc(c1)Cl)O)O | 10634944 | |||
11156438 | 9064 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
5261 | 9064 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
9635 | 9064 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
CHEMBL2364612 | 9064 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
DB11660 | 9064 | 0 | None | 1 | 2 | Human | 8.1 | pKi | ~ | 8.1 | Binding | Drug Central | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | None | |||
11156438 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | |||
11156438 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | |||
5261 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | |||
5261 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | |||
9635 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | |||
9635 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | |||
CHEMBL2364612 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | |||
CHEMBL2364612 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 | |||
DB11660 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 10634944 | |||
DB11660 | 9064 | 0 | None | 1 | 2 | Human | 8.6 | pKi | ~ | 8.6 | Binding | Guide to Pharmacology | 507 | 18 | 3 | 8 | 3.8 | O[C@@H](CCc1ccccc1)CC[C@H]1[C@H](O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)OCCCCO[N+](=O)[O-])O | 21396362 |