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P37231 | PPARG_HUMAN | Peroxisome proliferator-activated receptor gamma (PPARG)

3D structures mapped by conservation among orthologs

[ Domain: "Nuclear receptor ligand-binding domain" // Hormone_recep_1 ]

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[ Domain: "LIM domain-like" // zf-C4 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL434063 OBDepict CH 3 N N O HN H O HO O Ki = 0.0497 nM 495.58 CN(CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1)c1ccccn1 Homo sapiens CHEMBL4018944 single protein format
CHEMBL3678131 OBDepict OH O O H 3 C H Cl N CH 3 CH 3 N H O CH 3 H CH 3 H 3 C IC50 = 0.06 nM 547.1 Cc1c(C)n(Cc2cc(O[C@@H](C)C(=O)O)ccc2Cl)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)C)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3695832 OBDepict CH 3 N H H O N CH 3 H 3 C O OH IC50 = 0.13 nM 516.64 CC[C@@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1 Homo sapiens CHEMBL3738479 single protein format
CHEMBL594625 OBDepict I N H N N N N H S H HO H H OH N H O Ki = 0.17 nM 566.42 O=C(NC1CCC1)[C@H]1S[C@@H](n2cnc3c(NCc4cccc(I)c4)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL4018944 single protein format
CHEMBL3678134 OBDepict O N H CH 3 H N CH 3 CH 3 H 3 C H 3 C CH 3 Cl O H 3 C H O HO IC50 = 0.2 nM 561.12 Cc1c(C)n(Cc2cc(O[C@@H](C)C(=O)O)ccc2Cl)c2ccc(C(=O)N[C@@H](C)c3ccc(C(C)(C)C)cc3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678128 OBDepict HO O O CH 3 H Cl N CH 3 CH 3 N H O CH 3 H H 3 C H 3 C CH 3 IC50 = 0.2 nM 561.12 Cc1c(C)n(Cc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2ccc(C(=O)N[C@@H](C)c3ccc(C(C)(C)C)cc3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678133 OBDepict OH O O H 3 C H Cl N CH 3 CH 3 N H O CH 3 H Br IC50 = 0.3 nM 583.91 Cc1c(C)n(Cc2cc(O[C@@H](C)C(=O)O)ccc2Cl)c2ccc(C(=O)N[C@@H](C)c3ccc(Br)cc3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL65805 OBDepict OH O O O N CH 3 N O Ki = 0.4 nM 432.48 CN(CCOc1ccc(CC(Oc2ccccc2)C(=O)O)cc1)c1nc2ccccc2o1 Homo sapiens CHEMBL762535 single protein format
CHEMBL4752243 OBDepict CH 3 N N O NH H O OH O ClH Ki = 0.43 nM 532.04 CN(CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1)c1ccccn1.Cl Homo sapiens CHEMBL4667654 single protein format
CHEMBL3695782 OBDepict O NH H 3 C H 3 C N H 3 C CH 3 O OH IC50 = 0.5 nM 516.64 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NC(C)(C)c3ccccc3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695787 OBDepict H 3 C N H O N CH 3 H 3 C N IC50 = 0.54 nM 497.64 CCC(NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2C#N)cc1)c1ccccc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695780 OBDepict CH 3 O NH H 3 C H O N H 3 C H 3 C O HO IC50 = 0.54 nM 532.64 COc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccc(-c3ccccc3C(=O)O)cc2)cc1 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3678125 OBDepict HO O O CH 3 H Cl N CH 3 CH 3 N H O CH 3 H CH 3 H 3 C IC50 = 0.6 nM 547.1 Cc1c(C)n(Cc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)C)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678132 OBDepict OH O O H 3 C H Cl N CH 3 H 3 C NH O H 3 C H IC50 = 0.6 nM 545.08 Cc1c(C)n(Cc2cc(O[C@@H](C)C(=O)O)ccc2Cl)c2ccc(C(=O)N[C@@H](C)c3cccc(C4CC4)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678126 OBDepict HO O O CH 3 H Cl N CH 3 H 3 C NH O H 3 C H IC50 = 0.6 nM 545.08 Cc1c(C)n(Cc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2ccc(C(=O)N[C@@H](C)c3cccc(C4CC4)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678127 OBDepict HO O O CH 3 H Cl N CH 3 CH 3 N H O CH 3 H Br IC50 = 0.7 nM 583.91 Cc1c(C)n(Cc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2ccc(C(=O)N[C@@H](C)c3ccc(Br)cc3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3695765 OBDepict Br N H CH 3 H O N CH 3 H 3 C O OH IC50 = 0.73 nM 581.51 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3ccc(Br)cc3)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3695846 OBDepict F N H CH 3 H O N CH 3 H 3 C O OH IC50 = 0.79 nM 520.6 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3ccc(F)cc3)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3695847 OBDepict H 3 C N H H O N CH 3 H 3 C O OH IC50 = 0.8 nM 530.67 CCC[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695776 OBDepict CH 3 O NH H 3 C H O N H 3 C H 3 C O HO IC50 = 0.9 nM 532.64 COc1ccc([C@H](C)NC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccc(-c3ccccc3C(=O)O)cc2)cc1 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3678094 OBDepict F NH H 3 C H O N F F IC50 < 1.0 nM 408.42 C[C@@H](NC(=O)c1ccc2c(ccn2Cc2ccc(F)cc2F)c1)c1ccc(F)cc1 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3695821 OBDepict O N H S N CH 3 H 3 C O HO IC50 = 1.0 nM 494.62 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NCc3cccs3)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL556073 OBDepict HO O O H 3 C N O O F F F Cl IC50 = 1.0 nM 517.89 Cc1c(Cc2cccc(OCC(=O)O)c2)c2cc(OC(F)(F)F)ccc2n1C(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL1035292 single protein format
CHEMBL3699353 OBDepict O NH H 3 C H N H 3 C CH 3 F F F O OH IC50 = 1.0 nM 570.61 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3ccccc3C(F)(F)F)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL371341 OBDepict HO O O CH 3 H Cl O H 3 C N N O O F F F Cl IC50 = 1.0 nM 581.33 Cc1c(Oc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2cc(OC(F)(F)F)ccc2n1-c1noc2cc(Cl)ccc12 Homo sapiens CHEMBL830853 single protein format
CHEMBL3678098 OBDepict CH 3 NH O N H 3 C CH 3 F F IC50 < 1.0 nM 432.51 CCC(NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(F)cc1F)c1ccccc1 Homo sapiens CHEMBL3706350 single protein format
CHEMBL489651 OBDepict CH 3 O O CH 3 N O O F F F H 3 C H O OH IC50 = 1.0 nM 527.5 COc1ccc(C(=O)c2c(C)n(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc23)cc1 Homo sapiens CHEMBL940691 assay format
CHEMBL474295 OBDepict H 3 C O N O NH H O OH O CH 3 IC50 = 1.0 nM 484.55 CC(=O)c1ccccc1N[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1)C(=O)O Homo sapiens CHEMBL983195 cell-based format
CHEMBL460072 OBDepict H 3 C O N N CH 3 O O F O H 3 C H CH 3 O OH IC50 = 1.0 nM 492.5 COc1ccc(C(=O)c2c(C)n(Cc3ccc(F)c(O[C@@H](C)C(=O)O)c3)c3nc(OC)ccc23)cc1 Homo sapiens CHEMBL980782 assay format
CHEMBL181628 OBDepict CH 3 O N O CH 3 O O F F F CH 3 O OH IC50 = 1.0 nM 527.5 COc1ccc(C(=O)n2c(C)c(Cc3ccccc3OC(C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL361395 OBDepict CH 3 O N O CH 3 O O F F F CH 3 CH 3 O OH IC50 = 1.0 nM 541.52 COc1ccc(C(=O)n2c(C)c(Cc3ccccc3OC(C)(C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL435517 OBDepict H 3 C O N O H 3 C O O F F F H 3 C O HO IC50 = 1.0 nM 527.5 COc1ccc(C(=O)n2c(C)c(Cc3cccc(OC(C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL179330 OBDepict CH 3 O N O CH 3 O O F F F H 3 C H O OH IC50 = 1.0 nM 527.5 COc1ccc(C(=O)n2c(C)c(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL3678086 OBDepict H 3 C HN O N F F IC50 = 1.0 nM 404.46 CCC(NC(=O)c1ccc2c(ccn2Cc2ccc(F)cc2F)c1)c1ccccc1 Homo sapiens CHEMBL3706350 single protein format
CHEMBL522772 OBDepict OH O O H 3 C H Cl N H 3 C O O F F F Cl IC50 = 1.0 nM 554.35 Cc1c(Oc2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1ccc(Cl)c(O[C@@H](C)C(=O)O)c1 Homo sapiens CHEMBL940691 assay format
CHEMBL452051 OBDepict OH O O H 3 C H N H 3 C O O F F F Cl IC50 = 1.0 nM 531.91 Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@@H](C)C(=O)O)c1 Homo sapiens CHEMBL980782 assay format
CHEMBL192691 OBDepict CH 3 O N CH 3 O O F F F H 3 C H O OH IC50 = 1.0 nM 499.49 COc1ccc(-n2c(C)c(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL830853 single protein format
CHEMBL3699415 OBDepict O HN CH 3 N N CH 3 CH 3 O OH IC50 < 1.0 nM 543.67 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NC(C)c3cccc(C4CC4)n3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695882 OBDepict O NH H 3 C H N H 3 C Cl CH 3 IC50 < 1.0 nM 493.05 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@@H](C)c3ccccc3Cl)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695879 OBDepict CH 3 H 3 C N H H O CH 3 CH 3 N H 3 C H 3 C IC50 < 1.0 nM 528.74 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@@H](c3cccc(C(C)C)c3)C(C)C)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3699423 OBDepict Br N H CH 3 H O N CH 3 H 3 C O OH IC50 < 1.0 nM 581.51 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3cccc(Br)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695885 OBDepict Cl N H CH 3 H O N CH 3 H 3 C IC50 < 1.0 nM 493.05 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@H](C)c3cccc(Cl)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695901 OBDepict Br N H CH 3 H 3 C O N H 3 C CH 3 IC50 = 1.0 nM 551.53 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)NC(C)(C)c3ccc(Br)cc3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695889 OBDepict O NH H 3 C H N H 3 C CH 3 CH 3 CH 3 IC50 < 1.0 nM 500.69 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@H](C)c3cccc(C(C)C)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695868 OBDepict O HN H 3 C H N H 3 C CH 3 H 3 C F IC50 < 1.0 nM 490.62 Cc1c(F)cccc1[C@H](C)NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3699398 OBDepict O NH H 3 C H N H 3 C Br CH 3 O OH IC50 = 1.0 nM 581.51 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3ccccc3Br)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3699380 OBDepict O NH H 3 C H N H 3 C CH 3 F F F F IC50 < 1.0 nM 544.59 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@H](C)c3ccc(C(F)(F)F)c(F)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL459466 OBDepict H 3 C O N N CH 3 O O Cl O H 3 C H CH 3 O OH IC50 < 1.0 nM 508.96 COc1ccc(C(=O)c2c(C)n(Cc3ccc(Cl)c(O[C@@H](C)C(=O)O)c3)c3nc(OC)ccc23)cc1 Homo sapiens CHEMBL980782 assay format
CHEMBL410478 OBDepict H 3 C NH H O O HO O N CH 3 O Ki = 1.0 nM 510.59 C/C(=C/C(=O)c1ccccc1)N[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1)C(=O)O Homo sapiens CHEMBL841786 single protein format
CHEMBL107367 OBDepict O HN H O OH O N H 3 C O Ki = 1.1 nM 546.62 Cc1oc(-c2ccccc2)nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1 Homo sapiens CHEMBL759115 single protein format
CHEMBL3678129 OBDepict HO O O CH 3 H Cl N CH 3 CH 3 N H O CH 3 H H 3 C H 3 C CH 3 IC50 = 1.6 nM 561.12 Cc1c(C)n(Cc2ccc(Cl)c(O[C@@H](C)C(=O)O)c2)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)(C)C)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL3678135 OBDepict OH O O H 3 C H Cl N CH 3 CH 3 N H O CH 3 H H 3 C H 3 C CH 3 IC50 = 1.6 nM 561.12 Cc1c(C)n(Cc2cc(O[C@@H](C)C(=O)O)ccc2Cl)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)(C)C)c3)cc12 Homo sapiens CHEMBL3706350 single protein format
CHEMBL603424 OBDepict I N H N N N N H S H OH H H HO N H O Ki = 1.83 nM 566.42 O=C(NCC1CC1)[C@H]1S[C@@H](n2cnc3c(NCc4cccc(I)c4)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL4018944 single protein format
CHEMBL3695807 OBDepict CH 3 N H O N O HO IC50 = 2.0 nM 488.59 CCC(NC(=O)c1ccc2c(ccn2Cc2cccc(-c3ccc(C(=O)O)cc3)c2)c1)c1ccccc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL484001 OBDepict OH O O H S O N CH 3 O IC50 = 2.0 nM 477.58 Cc1oc(-c2ccccc2)nc1CCOc1ccc(C[C@H](OCC2CC2)C(=O)O)c2sccc12 Homo sapiens CHEMBL983195 cell-based format
CHEMBL221580 OBDepict H 3 C O N HN O S O O CH 3 F F F IC50 = 2.0 nM 502.51 COc1ccc(-c2c(C(=O)NS(C)(=O)=O)n(Cc3cccc(C(F)(F)F)c3)c3ccccc23)cc1 Homo sapiens CHEMBL855083 single protein format
CHEMBL484606 OBDepict CH 3 O H O OH S O N CH 3 O IC50 = 2.0 nM 465.57 CCCO[C@@H](Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O Homo sapiens CHEMBL983195 cell-based format
CHEMBL482740 OBDepict CH 3 O O OH S O N CH 3 O IC50 = 2.0 nM 507.65 CCCCCCOC(Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)c2ccsc12)C(=O)O Homo sapiens CHEMBL983195 cell-based format
CHEMBL484409 OBDepict CH 3 O H O OH S O N CH 3 O H 3 C H 3 C IC50 = 2.0 nM 479.6 CO[C@@H](Cc1ccc(OCCc2nc(-c3ccc(C(C)C)cc3)oc2C)c2ccsc12)C(=O)O Homo sapiens CHEMBL983195 cell-based format
CHEMBL3639947 OBDepict Cl N H O N CH 3 CH 3 O HO IC50 = 2.0 nM 523.03 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NCc3cccc(Cl)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3699414 OBDepict Br N N H CH 3 H O N CH 3 H 3 C O OH IC50 = 2.0 nM 582.5 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3cccc(Br)n3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695811 OBDepict O HN CH 3 H N CH 3 H 3 C + N O _ O O HO IC50 = 2.0 nM 547.61 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)c3ccc([N+](=O)[O-])cc3)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL460073 OBDepict CH 3 O O CH 3 N N O H 3 C Cl O CH 3 H O OH IC50 = 2.0 nM 508.96 COc1ccc(C(=O)c2c(C)n(Cc3cc(O[C@@H](C)C(=O)O)ccc3Cl)c3nc(OC)ccc23)cc1 Homo sapiens CHEMBL980782 assay format
CHEMBL3699404 OBDepict Br N N H CH 3 H O N CH 3 H 3 C O OH IC50 = 2.0 nM 582.5 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3ccc(Br)cn3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL462378 OBDepict CH 3 O O CH 3 N N O H 3 C F O CH 3 H O OH IC50 = 2.0 nM 492.5 COc1ccc(C(=O)c2c(C)n(Cc3cc(O[C@@H](C)C(=O)O)ccc3F)c3nc(OC)ccc23)cc1 Homo sapiens CHEMBL980782 assay format
CHEMBL519060 OBDepict H 3 C O O N CH 3 N O Cl O F F F H 3 C H O HO IC50 = 2.0 nM 574.94 COc1ccc2c(-c3c(C)n(Cc4cc(O[C@@H](C)C(=O)O)ccc4Cl)c4cc(OC(F)(F)F)ccc34)noc2c1 Homo sapiens CHEMBL940691 assay format
CHEMBL181937 OBDepict CH 3 O N O CH 3 O O F F F CH 3 H O OH IC50 = 2.0 nM 527.5 COc1ccc(C(=O)n2c(C)c(Cc3ccccc3O[C@@H](C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL559567 OBDepict OH O O N CH 3 O O F F F Cl IC50 = 2.0 nM 517.89 Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(OCC(=O)O)c1 Homo sapiens CHEMBL1035292 single protein format
CHEMBL3695774 OBDepict CH 3 O O N H O N H 3 C H 3 C O HO IC50 = 2.0 nM 546.62 COC(=O)c1ccc(CNC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccc(-c3ccccc3C(=O)O)cc2)cc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL364894 OBDepict H 3 C O O N N CH 3 O Cl O F F F H 3 C H O HO IC50 = 2.0 nM 574.94 COc1ccc2c(-n3c(C)c(Cc4cc(O[C@H](C)C(=O)O)ccc4Cl)c4cc(OC(F)(F)F)ccc43)noc2c1 Homo sapiens CHEMBL830853 single protein format
CHEMBL3695849 OBDepict O N H CH 3 N CH 3 CH 3 O OH IC50 = 2.0 nM 552.67 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NC(C)c3cccc4ccccc34)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL199244 OBDepict Cl N O H N O O OH F F F CH 3 CH 3 CH 3 IC50 = 2.0 nM 568.98 CC(C)(C)c1ccc(-n2c(C(=O)O)c(Oc3cccc(C(F)(F)F)c3)c3cc(Oc4cc(Cl)c[nH]4)ccc32)cc1 Homo sapiens CHEMBL880426 single protein format
CHEMBL3699377 OBDepict O N H CH 3 H N CH 3 Cl CH 3 F F F IC50 = 2.0 nM 561.05 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@H](C)c3cccc(C(F)(F)F)c3Cl)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695857 OBDepict H 3 C N H O N CH 3 O OH IC50 = 2.0 nM 502.61 CCC(NC(=O)c1ccc2c(c1)c(C)cn2Cc1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695888 OBDepict Cl F F F HN O N H 3 C CH 3 IC50 = 2.0 nM 547.02 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)NCc3ccc(Cl)cc3C(F)(F)F)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695884 OBDepict CH 3 O N H H 3 C H O N H 3 C H 3 C IC50 = 2.0 nM 488.63 COc1cccc([C@@H](C)NC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccc(-c3ccccc3)cc2)c1 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3695867 OBDepict O NH H 3 C H N N H 3 C CH 3 IC50 = 2.0 nM 459.59 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@@H](C)c3ccccn3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL431733 OBDepict H 3 C NH O H O H OH H N H HO N N Cl N N H I Ki = 2.18 nM 544.74 CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL4018944 single protein format
CHEMBL1946757 OBDepict H 3 C O O N N O N F F F O Cl CH 3 H O OH IC50 = 2.3 nM 561.9 COc1ccc2c(-n3c(=O)n(Cc4ccc(Cl)c(O[C@H](C)C(=O)O)c4)c4ccc(C(F)(F)F)cc43)noc2c1 Homo sapiens CHEMBL1947820 single protein format
CHEMBL263029 OBDepict CH 3 O O N O O H 3 C H 3 C O OH Ki = 2.4 nM 503.6 CCCc1c(OCCCCOc2ccc(OC(C)(C)C(=O)O)cc2)ccc2c(-c3ccccc3)noc12 Homo sapiens CHEMBL756623 single protein format
CHEMBL306229 OBDepict CH 3 O O HO O N CH 3 N O Ki = 2.5 nM 384.43 CCOC(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)C(=O)O Homo sapiens CHEMBL762535 single protein format
CHEMBL82602 OBDepict OH O O H 3 C O N CH 3 O S Ki = 3.0 nM 463.56 Cc1oc(-c2cccs2)nc1CCOc1ccc(CC(C)(Oc2ccccc2)C(=O)O)cc1 Homo sapiens CHEMBL841786 single protein format
CHEMBL178236 OBDepict CH 3 O O OH CH 3 N O O F F F O H 3 C IC50 = 3.0 nM 541.52 CCC(Oc1cccc(Cc2c(C)n(C(=O)c3ccc(OC)cc3)c3ccc(OC(F)(F)F)cc23)c1)C(=O)O Homo sapiens CHEMBL827222 single protein format
CHEMBL359548 OBDepict CH 3 O N O CH 3 O O F F F H 3 C H O OH IC50 = 3.0 nM 527.5 COc1ccc(C(=O)n2c(C)c(Cc3cccc(O[C@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL181554 OBDepict CH 3 O N O CH 3 O O F F F CH 3 CH 3 O OH IC50 = 3.0 nM 541.52 COc1ccc(C(=O)n2c(C)c(Cc3cccc(OC(C)(C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1 Homo sapiens CHEMBL827222 single protein format
CHEMBL3695850 OBDepict CH 3 HN O N H 3 C H 3 C O HO IC50 = 3.0 nM 530.67 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)NC(C)CCc3ccccc3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3678106 OBDepict H 3 C HN O N N Cl IC50 = 3.0 nM 403.91 CCC(NC(=O)c1ccc2c(ccn2Cc2ccc(Cl)nc2)c1)c1ccccc1 Homo sapiens CHEMBL3706350 single protein format
CHEMBL376627 OBDepict H 3 C O N HN O S O O F F F IC50 = 3.0 nM 564.59 COc1ccc(-c2c(C(=O)NS(=O)(=O)c3ccccc3)n(Cc3cccc(C(F)(F)F)c3)c3ccccc23)cc1 Homo sapiens CHEMBL855083 single protein format
CHEMBL3699396 OBDepict O HN H 3 C H N H 3 C CH 3 H 3 C O HO IC50 = 3.0 nM 516.64 Cc1ccccc1[C@H](C)NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3695895 OBDepict Cl N H CH 3 H O N CH 3 H 3 C IC50 = 3.0 nM 493.05 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(Cl)c3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL179542 OBDepict H 3 C O N O H 3 C O O F F F O OH CH 3 IC50 = 3.0 nM 541.52 CCC(Oc1ccccc1Cc1c(C)n(C(=O)c2ccc(OC)cc2)c2ccc(OC(F)(F)F)cc12)C(=O)O Homo sapiens CHEMBL827222 single protein format
CHEMBL3735987 OBDepict Cl N H CH 3 H O N CH 3 H 3 C O OH IC50 = 3.0 nM 537.06 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(Cl)c3)cc12 Homo sapiens CHEMBL3738479 single protein format
CHEMBL1230353 OBDepict CH 3 N H H O N CH 3 H 3 C O OH IC50 = 3.0 nM 516.64 CC[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1 Homo sapiens CHEMBL3738479 single protein format
CHEMBL3699359 OBDepict O N H H 3 C H O N H 3 C O H 3 C O HO IC50 = 3.0 nM 560.65 Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](C)C3COc4ccccc4O3)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL3699381 OBDepict O N H H 3 C H N H 3 C F F H 3 C F IC50 = 3.0 nM 512.58 Cc1c(C)n(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)N[C@H](C)c3c(F)ccc(F)c3F)cc12 Homo sapiens CHEMBL3706273 single protein format
CHEMBL594034 OBDepict HO O N H N N N CH 3 O IC50 = 3.0 nM 416.48 Cc1oc(-c2ccccc2)nc1CCCc1ccc(C[C@@H](C(=O)O)n2nccn2)cc1 Homo sapiens CHEMBL1066118 assay format
CHEMBL484607 OBDepict OH O O H S F F F O N CH 3 O IC50 = 3.0 nM 505.51 Cc1oc(-c2ccccc2)nc1CCOc1ccc(C[C@H](OCC(F)(F)F)C(=O)O)c2sccc12 Homo sapiens CHEMBL983195 cell-based format
CHEMBL521007 OBDepict H 3 C O O H 3 C N O CH 3 O S O H O OH CH 3 IC50 = 3.0 nM 497.57 COc1cc(OC)cc(-c2nc(CCOc3ccc(C[C@H](OC)C(=O)O)c4sccc34)c(C)o2)c1 Homo sapiens CHEMBL983195 cell-based format
CHEMBL483341 OBDepict CH 3 H 3 C O O HO S O N CH 3 O IC50 = 3.0 nM 479.6 Cc1oc(-c2ccccc2)nc1CCOc1ccc(CC(OCC(C)C)C(=O)O)c2sccc12 Homo sapiens CHEMBL983195 cell-based format
CHEMBL485187 OBDepict CH 3 O H O HO S O N H 3 C O IC50 = 3.0 nM 527.64 CCO[C@@H](Cc1ccc(OCCc2nc(-c3ccc(-c4ccccc4)cc3)oc2C)c2ccsc12)C(=O)O Homo sapiens CHEMBL983195 cell-based format