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Q07973 | CP24A_HUMAN | "1,25-dihydroxyvitamin D(3) 24-hydroxylase, mitochondrial" (CYP24A1)

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
CHEMBL389433 OBDepict Cl N N N N H IC50 = 2.3 nM 308.77 Clc1cccc(C(c2ccc3nc[nH]c3c2)n2ccnc2)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL389014 OBDepict H 2 C H OH H HO H H 3 C H H 3 C H S O NH IC50 = 7.4 nM 483.72 C=C1/C(=CC=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCS(=N)(=O)c2ccccc2)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL917755 cell-based format
CHEMBL255088 OBDepict CH 2 H OH H HO CH 3 CH 3 H + S HN _ O IC50 = 7.4 nM 481.7 C=C1/C(=CC=C2/CCC[C@]3(C)C([C@H](C)CC[S+](=N)([O-])c4ccccc4)=CCC23)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL926260 single protein format
CHEMBL3329769 OBDepict H 3 C O O CH 3 N H O N N Ki = 7.8 nM 453.54 COc1cc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329770 OBDepict CH 3 O O O CH 3 H 3 C N H O N N Ki = 9.7 nM 483.57 COc1cc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc(OC)c1OC Homo sapiens CHEMBL3369890 assay format
CHEMBL1627206 OBDepict H OH H HO H H 3 C H CH 3 H + S HN _ O IC50 = 9.7 nM 471.71 C[C@H](CC[S+](=N)([O-])c1ccccc1)[C@H]1CC[C@H]2/C(=C/C=C3C[C@@H](O)C[C@H](O)C3)CCC[C@@]21C Homo sapiens CHEMBL917755 cell-based format
CHEMBL3329774 OBDepict CH 3 O O CH 3 O H 3 C H 3 C CH 3 N O N Ki = 11.0 nM 448.56 COc1cc(/C=C/c2ccc(CCC(OC(=O)n3ccnc3)C(C)(C)C)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329778 OBDepict O H 3 C H 3 C CH 3 N N Ki = 13.0 nM 356.47 CC(C)(C)C(=O)/C(=C/c1ccc(/C=C/c2ccccc2)cc1)n1ccnc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344395 OBDepict CH 3 O O CH 3 N N N Ki = 14.0 nM 401.51 COc1cc(/C=C/c2cccc3c2ccn3CCCCn2ccnc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344394 OBDepict N N N Ki = 14.0 nM 341.46 C(=C/c1cccc2c1ccn2CCCCn1ccnc1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL1170908 OBDepict Cl N H O N H N IC50 = 15.0 nM 401.9 O=C(NC[C@@H](c1ccccc1)n1ccnc1)c1ccc(-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL253613 OBDepict Cl N H O N N IC50 = 15.0 nM 401.9 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL926258 cell-based format
CHEMBL3329767 OBDepict F N H O N N Ki = 19.0 nM 411.48 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(/C=C/c2ccc(F)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3360784 OBDepict H 2 C H HO H HO H CH 3 H H 3 C H N N Ki = 21.0 nM 396.58 C=C1[C@H](O)CC(=C/C=C2CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)Cn2ccnc2)C[C@H]1O Homo sapiens CHEMBL3369890 assay format
CHEMBL3329768 OBDepict CH 3 O NH O N N Ki = 24.0 nM 423.52 COc1ccc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344392 OBDepict N N N Ki = 26.0 nM 327.43 C(=C/c1cccc2c1ccn2CCCn1ccnc1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL2105705 OBDepict H 2 C H OH H HO H H 3 C CH 3 H S O O H 3 C H 3 C CH 3 IC50 = 27.0 nM 474.71 C=C1/C(=CC=C2/CCC[C@]3(C)C([C@H](C)C/C=C/S(=O)(=O)C(C)(C)C)=CC[C@@H]23)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL3369890 assay format
CHEMBL4797263 OBDepict CH 2 H OH H HO H CH 3 CH 3 H S O O H 3 C H 3 C CH 3 IC50 = 27.0 nM 460.68 C=C1/C(=CC=C2/CCC[C@]3(C)C([C@H](C)/C=C/S(=O)(=O)C(C)(C)C)=CC[C@@H]23)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL4709773 cell-based format
CHEMBL1171494 OBDepict O N H N N Ki = 28.0 nM 393.49 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL224719 OBDepict H 2 C H OH H HO H H 3 C H H 3 C H S O O IC50 = 28.0 nM 484.7 C=C1/C(=CC=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCS(=O)(=O)c2ccccc2)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL917755 cell-based format
CHEMBL3344393 OBDepict CH 3 O O CH 3 N N N Ki = 31.0 nM 387.48 COc1cc(/C=C/c2cccc3c2ccn3CCCn2ccnc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL157101 OBDepict Cl Cl O O N O N N N O CH 3 Ki = 33.0 nM 531.44 CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329771 OBDepict F N H O N N Ki = 36.0 nM 413.5 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(CCc2ccc(F)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344397 OBDepict N N N Ki = 37.0 nM 341.46 C(=C/c1ccc2c(ccn2CCCCn2ccnc2)c1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344396 OBDepict N N N Ki = 37.0 nM 327.43 C(=C/c1ccc2c(ccn2CCCn2ccnc2)c1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3360783 OBDepict H 3 C S O O O CH 3 H H H 3 C H H 2 C H OH Ki = 39.0 nM 512.76 C=C1CC[C@H](O)C/C1=C/C=C1CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)CCCOS(=O)(=O)c1ccc(C)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3360785 OBDepict CH 2 H HO H OH H H 3 C H H 3 C H N H Ki = 42.0 nM 413.65 C=C1[C@H](O)CC(=C/C=C2CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCNC2CC2)C[C@H]1O Homo sapiens CHEMBL3369890 assay format
CHEMBL3329779 OBDepict O H 3 C H 3 C CH 3 N N Ki = 42.0 nM 360.5 CC(C)(C)C(=O)C(Cc1ccc(CCc2ccccc2)cc1)n1ccnc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL1627207 OBDepict F + S NH _ O H 3 C H H H 3 C H H 2 C H OH H HO IC50 = 44.0 nM 501.71 C=C1/C(=CC=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CC[S+](=N)([O-])c2ccc(F)cc2)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL917755 cell-based format
CHEMBL1627203 OBDepict CH 2 H OH H HO H H 3 C H H 3 C H + S NH _ O IC50 = 50.0 nM 509.76 C=C1/C(=CC=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CC2([S+](=N)([O-])c3ccccc3)CC2)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL917755 cell-based format
CHEMBL1627204 OBDepict CH 2 H HO H H 3 C H H 3 C H + S NH _ O IC50 = 75.0 nM 467.72 C=C1CC[C@H](O)C/C1=C/C=C1CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)CC[S+](=N)([O-])c1ccccc1 Homo sapiens CHEMBL917755 cell-based format
CHEMBL3329772 OBDepict O N H N S NH O O N Ki = 91.0 nM 446.53 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(S(=O)(=O)Nc2ccccc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329769 OBDepict H 3 C O O CH 3 N H O N N IC50 = 110.0 nM 453.54 COc1cc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL4105510 OBDepict CH 3 O N NH N O IC50 = 110.0 nM 423.52 COc1ccc(C(CNC(=O)c2ccc(/C=C/c3ccccc3)cc2)n2ccnc2)cc1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL4080128 OBDepict CH 3 O O CH 3 HN O N N Cl IC50 = 120.0 nM 487.99 COc1ccc(/C=C/c2ccc(C(=O)NCC(c3ccc(Cl)cc3)n3ccnc3)cc2)cc1OC Homo sapiens CHEMBL4055735 single protein format
CHEMBL3329770 OBDepict CH 3 O O O CH 3 H 3 C N H O N N IC50 = 140.0 nM 483.57 COc1cc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc(OC)c1OC Homo sapiens CHEMBL3369890 assay format
CHEMBL4066700 OBDepict O N H N N F F F IC50 = 150.0 nM 461.49 O=C(NCC(c1ccc(C(F)(F)F)cc1)n1ccnc1)c1cccc(/C=C/c2ccccc2)c1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3329773 OBDepict CH 3 O O CH 3 O CH 3 CH 3 CH 3 Ki = 150.0 nM 352.47 COc1cc(/C=C/c2ccc(CCC(=O)C(C)(C)C)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL4087998 OBDepict Cl N HN N O IC50 = 160.0 nM 427.94 O=C(NCC(c1ccc(Cl)cc1)n1ccnc1)c1cccc(/C=C/c2ccccc2)c1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3329774 OBDepict CH 3 O O CH 3 O H 3 C H 3 C CH 3 N O N IC50 = 160.0 nM 448.56 COc1cc(/C=C/c2ccc(CCC(OC(=O)n3ccnc3)C(C)(C)C)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329778 OBDepict O H 3 C H 3 C CH 3 N N IC50 = 180.0 nM 356.47 CC(C)(C)C(=O)/C(=C/c1ccc(/C=C/c2ccccc2)cc1)n1ccnc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL4103700 OBDepict O N H N N F F F IC50 = 180.0 nM 461.49 O=C(NCC(c1ccc(C(F)(F)F)cc1)n1ccnc1)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL4104362 OBDepict O N H N N IC50 = 190.0 nM 393.49 O=C(NCC(c1ccccc1)n1ccnc1)c1cccc(/C=C/c2ccccc2)c1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3344395 OBDepict CH 3 O O CH 3 N N N IC50 = 190.0 nM 401.51 COc1cc(/C=C/c2cccc3c2ccn3CCCCn2ccnc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344394 OBDepict N N N IC50 = 200.0 nM 341.46 C(=C/c1cccc2c1ccn2CCCCn1ccnc1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3329777 OBDepict CH 3 O O CH 3 O CH 3 H 3 C CH 3 S O O CH 3 Ki = 210.0 nM 508.68 COc1cc(/C=C/c2ccc(CCC(OS(=O)(=O)c3ccc(C)cc3)C(C)(C)C)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL4087325 OBDepict Cl N HN N O IC50 = 210.0 nM 427.94 O=C(NCC(c1ccc(Cl)cc1)n1ccnc1)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3344400 OBDepict H 3 C S HN O O N Ki = 230.0 nM 444.6 Cc1ccc(S(=O)(=O)NCCCCn2ccc3c(/C=C/c4ccccc4)cccc32)cc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3329767 OBDepict F N H O N N IC50 = 260.0 nM 411.48 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(/C=C/c2ccc(F)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL75 OBDepict Cl Cl O O N H N O N N O CH 3 IC50 = 300.0 nM 531.44 CC(=O)N1CCN(c2ccc(OC[C@H]3CO[C@](Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 Homo sapiens CHEMBL4709768 cell-based format
CHEMBL4076840 OBDepict O N H N N CH 3 H 3 C IC50 = 310.0 nM 421.54 Cc1ccc(C(CNC(=O)c2ccc(/C=C/c3ccccc3)cc2)n2ccnc2)cc1C Homo sapiens CHEMBL4055735 single protein format
CHEMBL157101 OBDepict Cl Cl O O N O N N N O CH 3 IC50 = 312.0 nM 531.44 CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1 Homo sapiens CHEMBL917755 cell-based format
CHEMBL3344398 OBDepict CH 3 S N H O O N Ki = 340.0 nM 430.57 Cc1ccc(S(=O)(=O)NCCCn2ccc3c(/C=C/c4ccccc4)cccc32)cc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL4060725 OBDepict O N H N N F F F IC50 = 340.0 nM 461.49 O=C(NCC(c1ccccc1)n1ccnc1)c1cccc(/C=C/c2ccccc2C(F)(F)F)c1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3329768 OBDepict CH 3 O NH O N N IC50 = 340.0 nM 423.52 COc1ccc(/C=C/c2ccc(C(=O)NCC(c3ccccc3)n3ccnc3)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL4079445 OBDepict O N H N N F F F IC50 = 350.0 nM 461.49 O=C(NCC(c1ccccc1C(F)(F)F)n1ccnc1)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL4055735 single protein format
CHEMBL3344392 OBDepict N N N IC50 = 360.0 nM 327.43 C(=C/c1cccc2c1ccn2CCCn1ccnc1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3329776 OBDepict H 3 C O O CH 3 O CH 3 CH 3 CH 3 S O O CH 3 Ki = 380.0 nM 432.58 COc1cc(/C=C/c2ccc(CCC(OS(C)(=O)=O)C(C)(C)C)cc2)cc(OC)c1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3329775 OBDepict H 3 C S O O O H 3 C H 3 C CH 3 Ki = 400.0 nM 372.53 CC(C)(C)C(CCc1ccc(/C=C/c2ccccc2)cc1)OS(C)(=O)=O Homo sapiens CHEMBL3369890 assay format
CHEMBL1171494 OBDepict O N H N N IC50 = 400.0 nM 393.49 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344393 OBDepict CH 3 O O CH 3 N N N IC50 = 440.0 nM 387.48 COc1cc(/C=C/c2cccc3c2ccn3CCCn2ccnc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3329771 OBDepict F N H O N N IC50 = 510.0 nM 413.5 O=C(NCC(c1ccccc1)n1ccnc1)c1ccc(CCc2ccc(F)cc2)cc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344396 OBDepict N N N IC50 = 520.0 nM 327.43 C(=C/c1ccc2c(ccn2CCCn2ccnc2)c1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344397 OBDepict N N N IC50 = 520.0 nM 341.46 C(=C/c1ccc2c(ccn2CCCCn2ccnc2)c1)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344402 OBDepict O S O N Ki = 540.0 nM 401.53 O=S(OCCCn1ccc2c(/C=C/c3ccccc3)cccc21)c1ccccc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL1627205 OBDepict H 2 C H OH H HO H H 3 C H H 3 C H + S NH _ O IC50 = 549.0 nM 481.7 C=C1/C(=CC=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@@H](C)/C=C/[S+](=N)([O-])c2ccccc2)C[C@@H](O)C[C@@H]1O Homo sapiens CHEMBL917755 cell-based format
CHEMBL3329779 OBDepict O H 3 C H 3 C CH 3 N N IC50 = 600.0 nM 360.5 CC(C)(C)C(=O)C(Cc1ccc(CCc2ccccc2)cc1)n1ccnc1 Homo sapiens CHEMBL3369890 assay format
CHEMBL3344403 OBDepict CH 3 S O O O N Ki = 640.0 nM 431.56 Cc1ccc(S(=O)(=O)OCCCn2ccc3c(/C=C/c4ccccc4)cccc32)cc1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344399 OBDepict H 3 C O O H 3 C N HN S O O H 3 C Ki = 730.0 nM 490.63 COc1cc(/C=C/c2cccc3c2ccn3CCCNS(=O)(=O)c2ccc(C)cc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL3344401 OBDepict H 3 C O O H 3 C N NH S O O H 3 C Ki = 740.0 nM 504.65 COc1cc(/C=C/c2cccc3c2ccn3CCCCNS(=O)(=O)c2ccc(C)cc2)cc(OC)c1 Homo sapiens CHEMBL3383457 single protein format
CHEMBL363039 OBDepict CH 3 O O CH 3 IC50 = 900.0 nM 280.37 COc1ccc2c(c1)CCC(Cc1ccccc1C)C2=O Homo sapiens CHEMBL1252218 cell-based format