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P19793 | RXRA_HUMAN | Retinoic acid receptor RXR-alpha (RXRA)

3D structures mapped by conservation among orthologs

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

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

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[ Domain: pdbs with more than 2 multi-domains ]

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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
CHEMBL38 OBDepict CH 3 CH 3 CH 3 H 3 C CH 3 O OH Ki = 0.4 nM 300.44 CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1 Homo sapiens CHEMBL644683 single protein format
CHEMBL133915 OBDepict F F O CH 3 CH 3 H 3 C CH 3 F O OH Ki = 0.8 nM 444.49 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2ccc(F)cc2)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL130374 OBDepict F F O H 3 C H 3 C CH 3 S CH 3 O OH Ki = 0.8 nM 432.53 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2cccs2)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL90824 OBDepict CH 3 O CH 3 CH 3 CH 3 CH 3 H 3 C H 3 C O HO Ki = 1.0 nM 342.48 COc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL92430 OBDepict F O CH 3 CH 3 H 3 C H 3 C CH 3 CH 3 O OH Ki = 1.0 nM 374.5 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)C)cc(C(C)C)c1OCCF Homo sapiens CHEMBL798929 single protein format
CHEMBL329334 OBDepict CH 3 O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C CH 3 O OH Ki = 1.0 nM 370.53 COc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL130232 OBDepict F F O CH 3 CH 3 H 3 C F CH 3 O OH Ki = 1.0 nM 444.49 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2cccc(F)c2)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL42314 OBDepict F F O CH 3 H 3 C H 3 C CH 3 CH 3 CH 3 H 3 C CH 3 O OH Ki = 1.5 nM 420.54 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL430651 OBDepict F F O H 3 C H 3 C CH 3 N CH 3 CH 3 H 3 C H CH 3 O OH Ki = 1.6 nM 469.57 C/C(=CC(=O)O)c1ccc2[nH]cc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3OCC(F)F)c2c1 Homo sapiens CHEMBL800659 cell-based format
CHEMBL92447 OBDepict CH 3 O H 3 C H 3 C CH 3 N CH 3 CH 3 H 3 C H CH 3 O OH Ki = 1.6 nM 447.62 CCCOc1c(-c2c[nH]c3ccc(/C(C)=C/C(=O)O)cc23)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL800659 cell-based format
CHEMBL91185 OBDepict CH 3 O CH 3 CH 3 H 3 C CH 3 H 3 C H 3 C H 3 C H 3 C O HO Ki = 2.0 nM 398.59 CCC(C)(C)c1cc(/C(C)=CC=CC(C)=CC(=O)O)c(OC)c(C(C)(C)CC)c1 Homo sapiens CHEMBL798929 single protein format
CHEMBL88931 OBDepict F F O CH 3 CH 3 H 3 C H 3 C CH 3 CH 3 O OH Ki = 2.0 nM 392.49 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)C)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798929 single protein format
CHEMBL88740 OBDepict CH 3 O CH 3 CH 3 H 3 C H 3 C CH 3 CH 3 O OH Ki = 2.0 nM 356.51 CCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL315986 OBDepict CH 3 O CH 3 CH 3 H 3 C CH 3 H 3 C H 3 C H 3 C H 3 C O HO Ki = 2.0 nM 412.61 CCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)CC)cc1C(C)(C)CC Homo sapiens CHEMBL798929 single protein format
CHEMBL111589 OBDepict CH 3 O H 3 C CH 3 H 3 C H 3 C CH 3 CH 3 O OH Ki = 2.0 nM 368.52 COc1cc2c(cc1/C(C)=CC=CC(C)=CC(=O)O)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798930 single protein format
CHEMBL422088 OBDepict F F O CH 3 CH 3 H 3 C F CH 3 O OH Ki = 2.3 nM 444.49 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2ccccc2F)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL337393 OBDepict F F O CH 3 CH 3 H 3 C F F CH 3 O OH Ki = 2.6 nM 462.48 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2cc(F)cc(F)c2)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL92243 OBDepict F O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C CH 3 O OH Ki = 2.7 nM 416.58 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCCCF Homo sapiens CHEMBL800659 cell-based format
CHEMBL41260 OBDepict OH O H 3 C S O CH 3 CH 3 H 3 C H 3 C H 3 C CH 3 F F F Ki = 3.0 nM 504.61 C/C(=CC(=O)O)c1cc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3OCC(F)(F)F)cccc2s1 Homo sapiens CHEMBL807382 single protein format
CHEMBL91779 OBDepict H 3 C O CH 3 CH 3 CH 3 CH 3 H 3 C H 3 C O HO Ki = 3.0 nM 370.53 CCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL80236 OBDepict HO O H 3 C H H CH 3 H 3 C H 3 C CH 3 Ki = 3.0 nM 366.55 CC(/C=C/[C@H]1CCC[C@@H]1c1ccc2c(c1)C(C)(C)CCC2(C)C)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL130317 OBDepict F F O H 3 C H 3 C CH 3 O CH 3 O OH Ki = 3.0 nM 416.46 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(-c2ccco2)cc(C(C)C)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL41146 OBDepict F O H 3 C H 3 C CH 3 CH 3 CH 3 H 3 C S H 3 C O OH Ki = 3.0 nM 482.66 C/C(=CC(=O)O)c1cc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3OCCCF)cccc2s1 Homo sapiens CHEMBL807382 single protein format
CHEMBL93518 OBDepict HO O CH 3 CH 3 H 3 C H 3 C CH 3 Ki = 3.0 nM 338.49 CC(/C=C/C1(c2ccc3c(c2)C(C)(C)CCC3(C)C)CC1)=CC(=O)O Homo sapiens CHEMBL798316 single protein format
CHEMBL310047 OBDepict HO O CH 3 CH 3 H 3 C H 3 C CH 3 Ki = 3.0 nM 378.56 CC(/C=C/[C@]12CCC[C@@]1(c1ccc3c(c1)C(C)(C)CCC3(C)C)C2)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL423503 OBDepict OH O CH 3 CH 3 O H 3 C CH 3 CH 3 H 3 C F F F Ki = 3.0 nM 410.48 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)C)cc(C(C)C)c1OCC(F)(F)F Homo sapiens CHEMBL798929 single protein format
CHEMBL93246 OBDepict CH 3 O CH 3 CH 3 CH 3 N H 3 C H 3 C CH 3 H H 3 C O OH Ki = 3.2 nM 461.65 CCCCOc1c(-c2c[nH]c3ccc(/C(C)=C/C(=O)O)cc23)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL800659 cell-based format
CHEMBL110195 OBDepict CH 3 O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C CH 3 O OH Ki = 3.8 nM 412.61 CCCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL798931 cell-based format
CHEMBL414218 OBDepict H 3 C O CH 3 CH 3 CH 3 CH 3 H 3 C H 3 C O HO Ki = 4.0 nM 384.56 CCCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL75814 OBDepict HO O H 3 C CH 3 H CH 3 H 3 C H 3 C CH 3 Ki = 4.0 nM 380.57 CC(/C=C/[C@]1(C)CCC[C@@H]1c1ccc2c(c1)C(C)(C)CCC2(C)C)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL92284 OBDepict CH 3 O HO CH 3 H 3 C CH 3 CH 3 H 3 C Ki = 4.0 nM 352.52 CC(/C=C/C1(c2cc3c(cc2C)C(C)(C)CCC3(C)C)CC1)=CC(=O)O Homo sapiens CHEMBL798316 single protein format
CHEMBL109847 OBDepict CH 3 O CH 3 CH 3 H 3 C H 3 C CH 3 CH 3 O OH Ki = 4.0 nM 382.54 CCOc1cc2c(cc1/C(C)=CC=CC(C)=CC(=O)O)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798930 single protein format
CHEMBL312395 OBDepict HO O H 3 C CH 3 H CH 3 H 3 C H 3 C CH 3 Ki = 4.0 nM 380.57 CC(/C=C/[C@@]1(C)CCC[C@@H]1c1ccc2c(c1)C(C)(C)CCC2(C)C)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL335242 OBDepict OH O H 3 C F CH 3 O H 3 C H 3 C CH 3 CH 3 H 3 C CH 3 F F F Ki = 4.1 nM 456.52 CC(/C=C/C(F)=C(/C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)(F)F)=CC(=O)O Homo sapiens CHEMBL798016 cell-based format
CHEMBL131826 OBDepict CH 3 O CH 3 CH 3 H 3 C F H 3 C CH 3 CH 3 O OH Ki = 4.4 nM 402.55 CCCCOc1c(/C(C)=C(F)C=CC(C)=CC(=O)O)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL798016 cell-based format
CHEMBL89241 OBDepict H 3 C CH 3 H 3 C CH 3 CH 3 CH 3 H 3 C H 3 C O HO Ki = 4.6 nM 340.51 CC(/C=C/C=C(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1)=CC(=O)O Homo sapiens CHEMBL807376 single protein format
CHEMBL326673 OBDepict F F O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C F CH 3 O OH Ki = 4.8 nM 438.53 C/C(=C/C=C(F)/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F Homo sapiens CHEMBL798931 cell-based format
CHEMBL312737 OBDepict OH O H 3 C CH 3 H 3 C CH 3 CH 3 H 3 C Ki = 5.0 nM 378.56 CC(/C=C/C1=C(c2cc3c(cc2C)C(C)(C)CCC3(C)C)CCC1)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL291034 OBDepict CH 3 O CH 3 CH 3 CH 3 H 3 C H 3 C CH 3 S H 3 C O HO Ki = 5.0 nM 520.78 CCCCCCCOc1c(-c2cccc3sc(/C(C)=C/C(=O)O)cc23)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL366112 OBDepict CH 3 O CH 3 H 3 C N H 3 C CH 3 O HO IC50 = 6.0 nM 419.57 CCCOc1cc2c(cc1C(=C1CC1)c1ccc(C(=O)O)cn1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL832609 assay format
CHEMBL62880 OBDepict OH O O CH 3 H 3 C H 3 C CH 3 Ki = 6.0 nM 378.51 CC1(C)CCC(C)(C)c2cc(C3CCCc4oc(/C=C/C(=O)O)cc43)ccc21 Homo sapiens CHEMBL798300 single protein format
CHEMBL165734 OBDepict H 3 C O N CH 3 H 3 C H 3 C CH 3 CH 3 O HO Ki = 6.0 nM 407.55 CCCO/N=C(c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL162334 OBDepict OH N CH 3 CH 3 H 3 C H 3 C CH 3 O OH Ki = 6.0 nM 365.47 Cc1cc2c(cc1/C(=N/O)c1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL41890 OBDepict CH 3 O CH 3 CH 3 CH 3 H 3 C S H 3 C O HO Ki = 6.0 nM 422.59 CCOc1c(-c2cccc3sc(/C(C)=C/C(=O)O)cc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL424639 OBDepict F F O H 3 C CH 3 CH 3 CH 3 O OH Ki = 6.1 nM 426.5 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)C)cc(-c2ccccc2)c1OCC(F)F Homo sapiens CHEMBL798016 cell-based format
CHEMBL133896 OBDepict H 3 C O H 3 C H 3 C CH 3 F F F F F CH 3 O OH Ki = 6.3 nM 432.43 CCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(F)(F)C(F)(F)F)cc1C(C)C Homo sapiens CHEMBL798016 cell-based format
CHEMBL44420 OBDepict OH O H 3 C S CH 3 CH 3 CH 3 H 3 C H 3 C H 3 C CH 3 Ki = 7.0 nM 420.62 C/C(=CC(=O)O)c1cc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3C)cccc2s1 Homo sapiens CHEMBL807382 single protein format
CHEMBL43238 OBDepict F F O CH 3 CH 3 CH 3 H 3 C H 3 C CH 3 S CH 3 O HO Ki = 7.0 nM 500.65 C/C(=CC(=O)O)c1cc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3OCCC(F)F)cccc2s1 Homo sapiens CHEMBL807382 single protein format
CHEMBL166244 OBDepict H 2 C O N CH 3 H 3 C H 3 C CH 3 CH 3 O HO Ki = 7.0 nM 405.54 C=CCO/N=C(c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL92798 OBDepict CH 3 O CH 3 CH 3 N CH 3 H 3 C H H 3 C O HO Ki = 7.4 nM 433.59 CCCCOc1c(-c2c[nH]c3ccc(/C(C)=C/C(=O)O)cc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL800659 cell-based format
CHEMBL111217 OBDepict F F O CH 3 H 3 C H 3 C CH 3 F CH 3 CH 3 H 3 C CH 3 O OH Ki = 7.8 nM 438.53 CC(/C=C/C(F)=C(/C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F)=CC(=O)O Homo sapiens CHEMBL798016 cell-based format
CHEMBL208316 OBDepict CH 3 N CH 3 CH 3 CH 3 H 3 C CH 3 H 3 C O HO Ki = 8.0 nM 383.58 CCCN(C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc2c1CCC2(C)C Homo sapiens CHEMBL866288 single protein format
CHEMBL705 OBDepict CH 3 CH 3 CH 3 H 3 C CH 3 O OH Ki = 8.0 nM 300.44 CC1=C(/C=C/C(C)=CC=CC(C)=CC(=O)O)C(C)(C)CCC1 Homo sapiens CHEMBL798930 single protein format
CHEMBL109581 OBDepict CH 3 O CH 3 H 3 C CH 3 CH 3 H 3 C CH 3 O OH Ki = 8.0 nM 396.57 CCCOc1cc2c(cc1/C(C)=CC=CC(C)=CC(=O)O)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798930 single protein format
CHEMBL110921 OBDepict F F O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C F CH 3 O OH Ki = 8.2 nM 438.53 C/C(=C/C(F)=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F Homo sapiens CHEMBL798931 cell-based format
CHEMBL423465 OBDepict H 3 C O N CH 3 H 3 C H 3 C CH 3 CH 3 O HO Ki = 9.0 nM 379.5 CO/N=C(c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL184497 OBDepict CH 3 O CH 3 H 3 C N H 3 C CH 3 O HO IC50 = 10.0 nM 433.59 CCCCOc1cc2c(cc1C(=C1CC1)c1ccc(C(=O)O)cn1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL832609 assay format
CHEMBL325592 OBDepict F F O CH 3 CH 3 H 3 C CH 3 H 3 C H 3 C CH 3 H 3 C F O OH Ki = 10.6 nM 438.53 C/C(=C/C=C/C(C)=C(F)C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F Homo sapiens CHEMBL798931 cell-based format
CHEMBL164902 OBDepict N O N CH 3 CH 3 H 3 C H 3 C CH 3 O OH Ki = 11.0 nM 404.51 Cc1cc2c(cc1/C(=N/OCC#N)c1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL92050 OBDepict CH 3 O CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 H 3 C CH 3 O OH Ki = 11.4 nM 384.56 CCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL798931 cell-based format
CHEMBL348797 OBDepict OH N Br CH 3 CH 3 H 3 C H 3 C O OH Ki = 12.0 nM 430.34 CC1(C)CCC(C)(C)c2cc(/C(=N/O)c3ccc(C(=O)O)cc3)c(Br)cc21 Homo sapiens CHEMBL807375 single protein format
CHEMBL290761 OBDepict F F O CH 3 CH 3 CH 3 H 3 C H 3 C CH 3 S H 3 C O OH Ki = 12.0 nM 486.62 C/C(=CC(=O)O)c1cc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3OCC(F)F)cccc2s1 Homo sapiens CHEMBL807382 single protein format
CHEMBL583996 OBDepict CH 3 H 3 C CH 3 CH 3 H 3 C F O OH Ki = 12.0 nM 354.47 Cc1cc2c(cc1Cc1ccc(C(=O)O)c(F)c1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL1061278 cell-based format
CHEMBL288436 OBDepict CH 3 H 3 C CH 3 N CH 3 H 3 C O OH Ki = 12.9 nM 363.5 Cc1cc2c(cc1C1(c3ccc(C(=O)O)cn3)CC1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798016 cell-based format
CHEMBL420249 OBDepict H 3 C O CH 3 CH 3 CH 3 CH 3 H 3 C H 3 C CH 3 H 3 C O HO Ki = 14.0 nM 398.59 CCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL798929 single protein format
CHEMBL41742 OBDepict CH 3 O CH 3 CH 3 CH 3 H 3 C S H 3 C O HO Ki = 14.0 nM 436.62 CCCOc1c(-c2cccc3sc(/C(C)=C/C(=O)O)cc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL311113 OBDepict HO O H 3 C H H CH 3 H 3 C H 3 C CH 3 Ki = 15.0 nM 366.55 CC(/C=C/[C@@H]1CCC[C@@H]1c1ccc2c(c1)C(C)(C)CCC2(C)C)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL1023 OBDepict CH 3 CH 2 H 3 C H 3 C CH 3 CH 3 O OH Ki = 16.0 nM 348.49 C=C(c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798301 single protein format
CHEMBL290246 OBDepict CH 3 O CH 3 CH 3 O CH 3 H 3 C H 3 C F O OH Ki = 16.0 nM 452.57 CCCCOc1c(-c2cccc3cc(/C(C)=C(F)C(=O)O)oc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL379057 OBDepict H 3 C N H 3 C H 3 C CH 3 CH 3 H 3 C CH 3 H 3 C O HO Ki = 17.0 nM 371.57 CCCN(C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1 Homo sapiens CHEMBL866288 single protein format
CHEMBL205532 OBDepict CH 3 N CH 3 H 3 C CH 3 CH 3 CH 3 H 3 C O OH Ki = 18.0 nM 383.58 CCCN(C/C=C/C(C)=C/C(=O)O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL866288 single protein format
CHEMBL2372524 OBDepict H 2 N O NH O N H H 3 C H O NH H P O OH HO Ki = 19.0 nM 372.32 C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(=O)(O)O)C(=O)NCC(N)=O Homo sapiens CHEMBL807382 single protein format
CHEMBL79234 OBDepict OH O H 3 C CH 3 H 3 C H 3 C CH 3 Ki = 20.0 nM 364.53 CC(/C=C/C1=C(c2ccc3c(c2)C(C)(C)CCC3(C)C)CCC1)=CC(=O)O Homo sapiens CHEMBL798933 single protein format
CHEMBL294346 OBDepict CH 3 O CH 3 H 3 C H 3 C CH 3 O O HO Ki = 20.0 nM 408.54 COc1cc2c(cc1C1CCCc3oc(/C=C/C(=O)O)cc31)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798300 single protein format
CHEMBL305115 OBDepict O HN S O O CH 3 H 3 C H 3 C CH 3 Ki = 20.0 nM 435.59 CC1(C)CCC(C)(C)c2cc(C3CCCc4oc(/C=C5/SC(=O)NC5=O)cc43)ccc21 Homo sapiens CHEMBL798300 single protein format
CHEMBL277626 OBDepict H 3 C CH 3 H 3 C H 3 C CH 3 O HO IC50 = 21.0 nM 374.52 Cc1cc2c(cc1C(=C1CC1)c1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL832609 assay format
CHEMBL351943 OBDepict CH 3 CH 3 O N CH 3 CH 3 H 3 C H 3 C CH 3 O OH Ki = 21.0 nM 421.58 Cc1cc2c(cc1/C(=N/OCC(C)C)c1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL204725 OBDepict CH 3 N CH 3 CH 3 CH 3 H 3 C CH 3 H 3 C O HO Ki = 21.0 nM 397.6 CCCCN(C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc2c1CCC2(C)C Homo sapiens CHEMBL866288 single protein format
CHEMBL378926 OBDepict HO O CH 3 H N CH 3 H 3 C H 3 C CH 3 Ki = 21.0 nM 367.53 CC(/C=C/[C@@H]1CCCN1c1ccc2c(c1)C(C)(C)CCC2(C)C)=CC(=O)O Homo sapiens CHEMBL866288 single protein format
CHEMBL424269 OBDepict H 3 C O CH 3 CH 3 CH 3 F F F F F H 3 C O HO Ki = 21.4 nM 460.48 CCCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(F)(F)C(F)(F)F)cc1C(C)C Homo sapiens CHEMBL798016 cell-based format
CHEMBL289057 OBDepict CH 3 O CH 3 CH 3 O CH 3 H 3 C H 3 C O HO Ki = 22.0 nM 406.52 CCOc1c(-c2cccc3cc(/C(C)=C/C(=O)O)oc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL90254 OBDepict CH 3 O CH 3 CH 3 H 3 C CH 3 H 3 C H 3 C H 3 C H 3 C O HO Ki = 23.0 nM 426.64 CCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(C)(C)CC)cc1C(C)(C)CC Homo sapiens CHEMBL798929 single protein format
CHEMBL132568 OBDepict CH 3 O CH 3 CH 3 H 3 C F F F F F CH 3 O OH Ki = 25.6 nM 446.46 CCCOc1c(/C(C)=CC=CC(C)=CC(=O)O)cc(C(F)(F)C(F)(F)F)cc1C(C)C Homo sapiens CHEMBL798016 cell-based format
CHEMBL166201 OBDepict CH 3 O N CH 3 CH 3 CH 3 H 3 C H 3 C O OH Ki = 26.0 nM 393.53 CCO/N=C(c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL807375 single protein format
CHEMBL92487 OBDepict HO O CH 3 H 3 C O CH 3 CH 3 CH 3 H 3 C CH 3 H 3 C F F F Ki = 27.0 nM 438.53 C/C(=C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)(F)F Homo sapiens CHEMBL798929 single protein format
CHEMBL130231 OBDepict CH 3 H 3 C H 3 C CH 3 O CH 3 H 3 C F CH 3 F F H 3 C O HO Ki = 28.7 nM 466.58 CCC(C)(C)c1cc(/C(C)=C(F)C=CC(C)=CC(=O)O)c(OCC(F)F)c(C(C)(C)CC)c1 Homo sapiens CHEMBL798016 cell-based format
CHEMBL313647 OBDepict CH 3 H 3 C CH 3 H 3 C O H 3 C H 3 C CH 3 F F H 3 C O HO Ki = 29.0 nM 448.59 CCC(C)(C)c1cc(/C(C)=CC=CC(C)=CC(=O)O)c(OCC(F)F)c(C(C)(C)CC)c1 Homo sapiens CHEMBL798929 single protein format
CHEMBL314745 OBDepict H 3 C O CH 3 CH 3 S CH 3 H 3 C H 3 C O OH Ki = 29.6 nM 408.56 COc1c(-c2csc3ccc(/C(C)=C/C(=O)O)cc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL800659 cell-based format
CHEMBL205634 OBDepict CH 3 N H 3 C H 3 C CH 3 CH 3 H 3 C CH 3 H 3 C O HO Ki = 31.0 nM 357.54 CCN(C/C=C/C(C)=C/C(=O)O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1 Homo sapiens CHEMBL866288 single protein format
CHEMBL32505 OBDepict CH 3 CH 3 CH 3 CH 3 H 3 C H 3 C O OH IC50 = 32.0 nM 362.51 C/C(=Cc1ccc(C(=O)O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798314 single protein format
CHEMBL705 OBDepict CH 3 CH 3 CH 3 H 3 C CH 3 O OH IC50 = 32.0 nM 300.44 CC1=C(/C=C/C(C)=CC=CC(C)=CC(=O)O)C(C)(C)CCC1 Homo sapiens CHEMBL798314 single protein format
CHEMBL208213 OBDepict H 3 C N CH 3 H 3 C CH 3 CH 3 CH 3 H 3 C H 3 C O HO Ki = 37.0 nM 343.51 CC(/C=C/CN(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1)=CC(=O)O Homo sapiens CHEMBL866288 single protein format
CHEMBL312233 OBDepict OH O CH 3 H H H 2 C H 3 C CH 3 CH 3 H 3 C Ki = 38.0 nM 378.56 C=C1C[C@H](c2ccc3c(c2)C(C)(C)CCC3(C)C)[C@@H](/C=C/C(C)=C/C(=O)O)C1 Homo sapiens CHEMBL798933 single protein format
CHEMBL432140 OBDepict OH O O CH 3 H 3 C H 3 C CH 3 CH 3 Ki = 40.0 nM 392.54 Cc1cc2c(cc1C1CCCc3oc(/C=C/C(=O)O)cc31)C(C)(C)CCC2(C)C Homo sapiens CHEMBL798300 single protein format
CHEMBL62537 OBDepict OH O S CH 3 H 3 C H 3 C CH 3 Ki = 40.0 nM 394.58 CC1(C)CCC(C)(C)c2cc(C3CCCc4sc(/C=C/C(=O)O)cc43)ccc21 Homo sapiens CHEMBL798300 single protein format
CHEMBL427391 OBDepict H 3 C N H 3 C CH 3 H 3 C CH 3 H 3 C CH 3 O OH Ki = 42.0 nM 369.55 CCN(C/C=C/C(C)=C/C(=O)O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Homo sapiens CHEMBL866288 single protein format
CHEMBL41675 OBDepict CH 3 O CH 3 CH 3 O CH 3 H 3 C H 3 C O HO Ki = 44.0 nM 420.55 CCCOc1c(-c2cccc3cc(/C(C)=C/C(=O)O)oc23)cc(C(C)C)cc1C(C)C Homo sapiens CHEMBL807382 single protein format
CHEMBL290399 OBDepict F O CH 3 H 3 C O H 3 C CH 3 H 3 C O OH Ki = 47.0 nM 438.54 C/C(=CC(=O)O)c1cc2cccc(-c3cc(C(C)C)cc(C(C)C)c3OCCCF)c2o1 Homo sapiens CHEMBL807382 single protein format
CHEMBL205600 OBDepict H 3 C N H 3 C CH 3 H 3 C CH 3 H 3 C O HO Ki = 47.0 nM 369.55 CCCN(C/C=C/C(C)=C/C(=O)O)c1ccc2c(c1)C(C)(C)CCC2(C)C Homo sapiens CHEMBL866288 single protein format
CHEMBL107555 OBDepict CH 3 O H 3 C H 3 C CH 3 F F F CH 3 CH 3 H 3 C H 3 C O HO Ki = 50.3 nM 438.53 CCOc1c(/C(=CC=CC(C)=CC(=O)O)C(F)(F)F)cc(C(C)(C)C)cc1C(C)(C)C Homo sapiens CHEMBL798931 cell-based format