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P31639 | SC5A2_HUMAN | Sodium/glucose cotransporter 2 (SLC5A2)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL565781 OBDepict OH H O H HO O H HO H HO Cl O F F F IC50 = 0.3 nM 476.83 OC[C@H]1O[C@]2(OCc3cc(Cl)c(Cc4ccc(OC(F)(F)F)cc4)cc32)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1050643 cell-based format
CHEMBL1164052 OBDepict CH O Cl H O H HO H H HO OH H OH H 3 C IC50 = 0.3 nM 460.95 C#CCOCc1cc(Cl)c(Cc2ccc(CC)cc2)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL1167866 cell-based format
CHEMBL3703868 OBDepict CH 3 O Cl O H O H 3 C H OH H S H HO H 3 C H HO IC50 = 0.308 nM 454.97 CCOc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)cc(OC)c2Cl)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3985666 OBDepict CH 2 Cl O H O H OH H H OH HO H HO IC50 = 0.366 nM 432.9 C=Cc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3941422 OBDepict HO H O H HO H H OH H OH O O Cl IC50 = 0.366 nM 448.9 OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCO3)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703920 OBDepict CH 2 Cl O H O H OH H H OH HO H HO IC50 = 0.37 nM 432.9 C=Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703908 OBDepict HO H O H HO H H OH H OH O O Cl IC50 = 0.37 nM 448.9 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCO3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3888404 assay format
CHEMBL3703912 OBDepict CH 3 Cl O O H O H OH H H OH HO H HO IC50 = 0.4 nM 436.89 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3978611 OBDepict CH 3 Cl O O H O H OH H H OH HO H HO IC50 = 0.404 nM 436.89 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)OCO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703785 OBDepict CH 3 O Br H O H OH H H OH HO H HO IC50 = 0.44 nM 479.37 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703855 OBDepict H 3 C S H O H OH H H OH H OH OH Cl O O IC50 = 0.454 nM 454.93 CS[C@H]1O[C@@H](c2cc(Cc3ccc4c(c3)OCCO4)c(Cl)cc2O)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703921 OBDepict HO H O H HO H H OH H OH O Cl IC50 = 0.463 nM 446.93 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCO3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL4114400 OBDepict CH 3 O Cl O H O H HO H S H HO HO H HO IC50 = 0.47 nM 468.96 COc1ccc(Cc2cc([C@@H]3O[C@H](SO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703870 OBDepict OH H O H HO H H HO H HO Cl N CH 3 CH 3 IC50 = 0.475 nM 447.96 CN(C)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4111780 OBDepict CH 3 O Cl O O H O H OH H S H OH H 3 C H HO IC50 = 0.49 nM 468.96 CCOc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL4112174 OBDepict CH 3 Cl H O H HO H H HO HO H HO IC50 = 0.49 nM 446.97 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL4297625 OBDepict CH 3 H O H HO O H H HO O OH H OH IC50 = 0.5 nM 416.47 CCc1ccc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc2c(c1)OCCO2 Homo sapiens CHEMBL4727639 single protein format
CHEMBL4113334 OBDepict CH 3 O Cl H O H OH H S H OH H 3 C H HO IC50 = 0.5 nM 450.98 COc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703864 OBDepict H 2 C O Cl H O H OH H S H OH H 3 C H HO O CH 3 IC50 = 0.504 nM 466.98 C=CCOc1cc(Cl)c(Cc2ccc(OC)cc2)cc1[C@@H]1O[C@H](SC)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703792 OBDepict CH 3 O Cl H O H OH H H OH HO H HO IC50 = 0.55 nM 448.94 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3654936 OBDepict CH 3 O Cl S H O H HO H H HO HO H HO IC50 = 0.55 nM 466.98 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)SCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703867 OBDepict CH 3 O Cl H O H HO H S H HO CH 3 H OH O O IC50 = 0.551 nM 468.95 COc1cc([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)cc(Cc2ccc3c(c2)OCCO3)c1Cl Homo sapiens CHEMBL3705440 assay format
CHEMBL3937224 OBDepict CH 3 O Cl H O H OH H H OH HO H HO IC50 = 0.551 nM 448.94 CCOc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3947988 OBDepict CH 3 O Cl S H O H HO H H HO HO H HO IC50 = 0.552 nM 466.98 COc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)SCCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703929 OBDepict OH H O H HO H H HO H HO O Cl CH 2 CH 3 IC50 = 0.574 nM 446.93 C=C(C)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4114272 OBDepict CH 3 CH 3 H O H HO H H HO HO H HO IC50 = 0.59 nM 426.55 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2C)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL4108764 OBDepict CH 3 O Cl H O H HO H H HO HO H HO IC50 = 0.6 nM 448.94 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703788 OBDepict CH 3 Br H O H OH H H OH HO H HO IC50 = 0.61 nM 477.4 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703861 OBDepict OH H O H HO H H HO H HO Cl O O IC50 = 0.616 nM 462.93 OC[C@H]1O[C@@H](c2cc(Cc3ccc4c(c3)OCCO4)c(Cl)c3c2CCC3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL4114842 OBDepict CH 3 O Cl H O H OH H H OH HO H HO IC50 = 0.62 nM 462.97 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3926703 OBDepict CH 3 Cl H O H OH H H OH HO H HO IC50 = 0.627 nM 432.94 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703852 OBDepict CH 3 O Cl H O H HO H S H HO CH 3 H OH O O IC50 = 0.628 nM 468.96 COc1cc(Cl)c(Cc2ccc3c(c2)OCCO3)cc1[C@@H]1O[C@H](SC)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703848 OBDepict CH 3 S H O H OH H H OH H HO Cl O O IC50 = 0.629 nM 438.93 CS[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc4c(c3)OCCO4)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL4126863 OBDepict H 3 C Cl HO H O H OH H H OH HO H HO IC50 = 0.63 nM 408.88 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2Cl)cc1 Homo sapiens CHEMBL4122963 cell-based format
CHEMBL3654932 OBDepict CH 3 Cl H O H OH H H OH HO H HO IC50 = 0.63 nM 432.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703913 OBDepict HO H O H HO H H OH H OH O O Cl IC50 = 0.65 nM 462.93 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCCO3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3888404 assay format
CHEMBL3949540 OBDepict HO H O H HO H H OH H OH O O Cl IC50 = 0.651 nM 462.93 OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCCO3)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3978805 OBDepict CH 3 Br H O H OH H H OH HO H HO IC50 = 0.661 nM 477.39 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Br)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4110395 OBDepict HO H O H HO H H OH H OH S Cl IC50 = 0.67 nM 463.0 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCS3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3888404 assay format
CHEMBL3125150 OBDepict CH 3 O Cl H O H HO H CH 3 H OH H OH IC50 = 0.67 nM 392.88 CCOc1ccc(Cc2cc([C@@H]3O[C@H](C)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1 Homo sapiens CHEMBL3128639 single protein format
CHEMBL3703872 OBDepict HO H O H HO H H OH H OH Cl IC50 = 0.678 nM 444.96 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCC3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703789 OBDepict CH 3 O Cl H O H OH H H OH HO H HO IC50 = 0.68 nM 434.92 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3911924 OBDepict CH 3 O Cl H O H OH H H OH HO H HO IC50 = 0.681 nM 434.92 COc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3925359 OBDepict CH 3 O Cl O H O H OH H 3 C H S H OH H 3 C H HO IC50 = 0.685 nM 481.01 CCOc1ccc(Cc2cc([C@H]3O[C@@H](SC)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CC(C)O3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703898 OBDepict CH 3 O Cl O H O H OH H 3 C H S H OH H 3 C H HO IC50 = 0.69 nM 481.01 CCOc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CC(C)O3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3891805 OBDepict CH 3 O Cl O OH CH 3 HO HO IC50 = 0.69 nM 392.88 CCOc1ccc(Cc2cc(C3OC(C)C(O)C(O)C3O)ccc2Cl)cc1 Homo sapiens CHEMBL3889254 single protein format
CHEMBL3703885 OBDepict CH 3 Cl O H O H OH H 3 C H H OH HO H HO IC50 = 0.706 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CC(C)O3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4112401 OBDepict CH 3 O Cl O O H O H OH H S H OH H 3 C H HO IC50 = 0.71 nM 482.98 CCOc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703800 OBDepict CH 3 Cl O H O H OH H H OH HO H HO IC50 = 0.715 nM 434.92 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3654933 OBDepict CH 3 F F H O H OH H H OH OH H OH IC50 = 0.718 nM 448.51 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2C(F)F)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703903 OBDepict CH 3 Cl O H O H 3 C H OH H H OH HO H HO IC50 = 0.721 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3C)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703879 OBDepict CH 3 O Cl O H O H OH H H 3 C H OH H HO IC50 = 0.728 nM 434.92 CCOc1ccc(Cc2cc([C@@H]3O[C@H](C)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3654931 OBDepict CH 3 O F F H O H OH H H OH OH H OH IC50 = 0.73 nM 450.48 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2C(F)F)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3898668 OBDepict CH 3 O F F H O H OH H H OH OH H OH IC50 = 0.734 nM 450.48 COc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2C(F)F)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3972146 OBDepict CH 3 O Br H O H OH H H OH HO H HO IC50 = 0.738 nM 493.39 CCOc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Br)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703871 OBDepict CH 2 Cl H O H OH H H OH HO H HO IC50 = 0.742 nM 430.93 C=Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703803 OBDepict CH 3 Cl O H O H HO H H HO HO H HO IC50 = 0.75 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703787 OBDepict CH 3 O Br H O H OH H H OH HO H HO IC50 = 0.75 nM 493.39 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3964753 OBDepict CH 3 Cl O H O H HO H H HO HO H HO IC50 = 0.753 nM 448.94 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)OCCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL1672796 OBDepict OH H O H HO H H HO H HO Cl N S S IC50 = 0.772 nM 453.97 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ncc(-c4ccsc4)s3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1680964 cell-based format
CHEMBL1819199 OBDepict CH 3 S Cl O H O H OH H H OH O H OH IC50 = 0.778 nM 495.04 CSc1ccc(Cc2cc3c(cc2Cl)OCCCCCOC[C@H]2O[C@@H]3[C@H](O)[C@@H](O)[C@@H]2O)cc1 Homo sapiens CHEMBL1821091 cell-based format
CHEMBL3703865 OBDepict CH 3 O Cl O H O H 3 C H OH H S H OH H 3 C H HO IC50 = 0.783 nM 454.97 CCOc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)c(OC)cc2Cl)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703836 OBDepict OH H O H OH H H OH H HO Cl O O IC50 = 0.788 nM 420.85 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc4c(c3)OC=CO4)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3703791 OBDepict CH 3 O CH 3 H O H OH H H OH HO H HO IC50 = 0.79 nM 414.5 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2C)CCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3902913 OBDepict CH 3 O CH 3 H O H OH H H OH HO H HO IC50 = 0.793 nM 414.5 COc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2C)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703930 OBDepict OH H O H HO H H HO H HO O Cl CH 3 CH 3 IC50 = 0.794 nM 448.94 CC(C)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL1784412 OBDepict HO H O H HO H H HO H OH HO Cl N S O IC50 = 0.797 nM 453.9 OC[C@H]1O[C@@H](c2cc(Cc3ncc(-c4ccco4)s3)c(Cl)cc2O)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL1788054 cell-based format
CHEMBL3125314 OBDepict OH H O H HO H H HO H OH Cl D D O D D D IC50 = 0.8 nM 399.88 [2H]C([2H])([2H])Oc1ccc(C([2H])([2H])c2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1 Homo sapiens CHEMBL3130910 cell-based format
CHEMBL565377 OBDepict OH H O H HO O H HO H HO Cl F CH 3 IC50 = 0.8 nM 424.85 Cc1cccc(Cc2cc3c(cc2Cl)CO[C@]32O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1F Homo sapiens CHEMBL1050643 cell-based format
CHEMBL2414623 OBDepict HO H O H HO H H OH H OH Cl S N IC50 = 0.8 nM 447.94 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(-c4cccnc4)s3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL2415852 cell-based format
CHEMBL4107453 OBDepict CH 3 S Cl O O H O H OH H H OH HO H HO IC50 = 0.8 nM 454.93 CSc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703892 OBDepict HO H O H OH H H OH H OH Cl H 3 C IC50 = 0.808 nM 418.92 Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCC3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4128909 OBDepict OH H O H HO H H HO H OH HO Cl CH 3 IC50 = 0.81 nM 394.85 Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2Cl)cc1 Homo sapiens CHEMBL4122963 cell-based format
CHEMBL3703802 OBDepict CH 3 O Cl O H O H OH H H OH HO H HO IC50 = 0.83 nM 450.92 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3963308 OBDepict CH 3 O Cl O H O H OH H H OH HO H HO IC50 = 0.833 nM 450.92 CCOc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703889 OBDepict CH 3 Cl O H O H OH H 3 C H H OH HO H HO IC50 = 0.835 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OC(C)C3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3977952 OBDepict CH 3 Cl O H O H HO H H HO HO H HO IC50 = 0.845 nM 448.94 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCCO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4110562 OBDepict CH 3 S Cl O O H O H HO H H HO HO H HO IC50 = 0.85 nM 468.96 CSc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703875 OBDepict HO H O H HO H H OH H OH O Cl IC50 = 0.85 nM 460.95 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCCC3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3888404 assay format
CHEMBL3703798 OBDepict CH 3 Cl O H O H HO H H HO HO H HO IC50 = 0.85 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3920248 OBDepict HO H O H HO H H OH H OH O Cl IC50 = 0.851 nM 460.95 OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2OCCC3)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL4114016 OBDepict CH 3 O CH 3 H O H HO H H HO HO H HO IC50 = 0.86 nM 428.53 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2C)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3640027 OBDepict OH H O H HO H H HO H HO CH 3 O O IC50 = 0.86 nM 442.51 Cc1c(Cc2ccc3c(c2)OCCO3)cc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c1CCC2 Homo sapiens CHEMBL3705440 assay format
CHEMBL4114498 OBDepict CH 3 Br H O H HO H H HO HO H HO IC50 = 0.86 nM 491.42 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703809 OBDepict HO H O H HO H H OH H OH Cl S IC50 = 0.865 nM 420.91 OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc4sccc4c3)c2)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3654920 OBDepict CH 3 O Cl O H O H 3 C H OH H H OH HO H HO IC50 = 0.867 nM 464.94 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3C)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL4113882 OBDepict CH 3 O Br H O H OH H H OH HO H HO IC50 = 0.87 nM 507.42 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL4111439 OBDepict CH 3 Cl S H O H OH H H OH HO H HO IC50 = 0.87 nM 450.98 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)SCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3703909 OBDepict OH H O H HO H H HO H HO O O Cl CH 3 CH 3 IC50 = 0.872 nM 450.92 CC(C)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703905 OBDepict HO H O H HO H H OH H OH O Cl IC50 = 0.88 nM 460.95 OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCCO3)[C@H](O)[C@@H](O)[C@@H]1O Homo sapiens CHEMBL3888404 assay format
CHEMBL3703793 OBDepict CH 3 Cl O H O H OH H H OH HO H HO IC50 = 0.88 nM 434.92 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CCO3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3894077 OBDepict HO H O H HO H H OH H OH O Cl IC50 = 0.881 nM 460.95 OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCCO3)[C@@H](O)[C@H](O)[C@H]1O Homo sapiens CHEMBL3705440 assay format
CHEMBL3986424 OBDepict CH 3 Cl O H O H OH H H OH HO H HO IC50 = 0.884 nM 434.92 CCc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)CCO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3703887 OBDepict CH 3 Cl O H O H OH H 3 C H H OH HO H HO IC50 = 0.885 nM 462.97 CCCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)CC(C)O3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL3654911 OBDepict CH 3 Cl O H O CH 3 H OH H H OH HO H HO IC50 = 0.891 nM 448.94 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)C(C)CO3)cc1 Homo sapiens CHEMBL3705440 assay format
CHEMBL1819096 OBDepict CH 3 O Cl O H O H OH H H OH O H HO IC50 = 0.899 nM 493.0 CCOc1ccc(Cc2cc3c(cc2Cl)OCCCCCOC[C@H]2O[C@@H]3[C@H](O)[C@@H](O)[C@@H]2O)cc1 Homo sapiens CHEMBL1821091 cell-based format
CHEMBL1165446 OBDepict CH 3 O Cl H O H OH H H OH HO H HO CH 3 IC50 = 0.9 nM 436.93 CCc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(COC)cc2Cl)cc1 Homo sapiens CHEMBL1167866 cell-based format
CHEMBL1163912 OBDepict CH 3 O Cl H O H HO H H HO OH H OH O CH 3 IC50 = 0.9 nM 466.96 CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(CCOC)cc2Cl)cc1 Homo sapiens CHEMBL1167866 cell-based format
CHEMBL3654935 OBDepict CH 3 O Cl S H O H OH H H OH HO H HO IC50 = 0.9 nM 452.96 COc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)SCC3)cc1 Homo sapiens CHEMBL3888404 assay format
CHEMBL3920190 OBDepict CH 3 O Cl S H O H OH H H OH HO H HO IC50 = 0.902 nM 452.96 COc1ccc(Cc2cc([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c3c(c2Cl)SCC3)cc1 Homo sapiens CHEMBL3705440 assay format