HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q9BPX1 | DHB14_HUMAN | 17-beta-hydroxysteroid dehydrogenase 14 (HSD17B14)

3D structures mapped by conservation among orthologs

[ Domain: "NAD(P)-binding Rossmann-fold domains" // adh_short_C2 ]

download pymol session

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

download pymol session



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4175585 OBDepict CH 2 N OH F F OH Ki = 1.5 nM 325.31 C=C(c1ccc(F)c(O)c1)c1cccc(-c2cccc(O)c2F)n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL4165659 OBDepict O OH F Ki = 6.0 nM 266.27 O=C(c1ccc(F)c(O)c1)c1ccc2ccccc2c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL4176263 OBDepict CH 3 N O OH F Ki = 6.0 nM 281.29 Cc1ccc2nc(C(=O)c3ccc(F)c(O)c3)ccc2c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL4164239 OBDepict O N OH F H 3 C HO Ki = 6.0 nM 373.38 Cc1cc(-c2ccc3ccc(C(=O)c4ccc(F)c(O)c4)nc3c2)ccc1O Homo sapiens CHEMBL4155465 assay format
CHEMBL3827618 OBDepict O N OH F OH HO Ki = 7.0 nM 325.3 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(O)c(O)c2)n1 Homo sapiens CHEMBL3830811 single protein format
CHEMBL3965905 OBDepict OH N O OH F Ki = 7.0 nM 309.3 O=C(c1ccc(F)c(O)c1)c1cccc(-c2cccc(O)c2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3894507 OBDepict CH 3 N H 3 C N O HO F Ki = 7.0 nM 336.37 CN(C)c1cccc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)c1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3941236 OBDepict O N F HO F F OH Ki = 9.0 nM 345.28 O=C(c1cccc(-c2cccc(O)c2F)n1)c1ccc(F)c(O)c1F Homo sapiens CHEMBL3861918 assay format
CHEMBL4168004 OBDepict N N O OH F Ki = 9.0 nM 292.27 N#Cc1ccc2ccc(C(=O)c3ccc(F)c(O)c3)nc2c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3932068 OBDepict O N HO F H 3 C CH 3 OH OH Ki = 9.0 nM 429.45 Cc1cc(-c2ccc(C(=O)c3ccc(F)c(O)c3)nc2-c2ccc(O)c(C)c2)ccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4172463 OBDepict O N OH F N N N H N Ki = 10.0 nM 335.3 O=C(c1ccc(F)c(O)c1)c1ccc2ccc(-c3nnn[nH]3)cc2n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3913249 OBDepict O N HO HO F F OH Ki = 11.0 nM 343.29 O=C(c1cccc(-c2cccc(O)c2F)n1)c1ccc(F)c(O)c1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4171902 OBDepict O N OH F Ki = 12.0 nM 267.26 O=C(c1ccc(F)c(O)c1)c1ccc2ccccc2n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3949996 OBDepict O N OH F F OH Ki = 13.0 nM 327.29 O=C(c1ccc(F)c(O)c1)c1cccc(-c2cccc(O)c2F)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3938843 OBDepict O N HO F F CH 3 OH OH Ki = 15.0 nM 433.41 Cc1cc(-c2nc(C(=O)c3ccc(F)c(O)c3)ccc2-c2cccc(O)c2F)ccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL3911402 OBDepict O N HO F F OH Ki = 17.0 nM 327.29 O=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(F)c2)cn1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3923116 OBDepict HO HO O F OH Ki = 21.0 nM 324.31 O=C(c1cccc(-c2cccc(O)c2F)c1)c1cccc(O)c1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4174579 OBDepict OH O HN N O OH F Ki = 23.0 nM 340.31 O=C(O)CNc1ccc2ccc(C(=O)c3ccc(F)c(O)c3)nc2c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL1928186 OBDepict O N OH F H 3 C HO Ki = 24.0 nM 323.32 Cc1cc(-c2ccc(C(=O)c3ccc(F)c(O)c3)nc2)ccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL1928172 OBDepict O N HO F CH 3 OH Ki = 26.0 nM 323.32 Cc1cc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)ccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4164576 OBDepict NH 2 N O OH F Ki = 34.0 nM 282.27 Nc1ccc2ccc(C(=O)c3ccc(F)c(O)c3)nc2c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3922253 OBDepict O N OH F F HO Ki = 36.0 nM 327.29 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(O)c(F)c2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL4169325 OBDepict CH 3 N N OH F F OH Ki = 42.0 nM 328.32 CN(c1ccc(F)c(O)c1)c1cccc(-c2cccc(O)c2F)n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3962753 OBDepict OH N O HO OH Ki = 44.0 nM 307.31 O=C(c1cccc(-c2cccc(O)c2)n1)c1cccc(O)c1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4177499 OBDepict F OH N H N F OH Ki = 47.0 nM 314.29 Oc1cc(Nc2cccc(-c3cccc(O)c3F)n2)ccc1F Homo sapiens CHEMBL4155465 assay format
CHEMBL3954708 OBDepict O N HO F OH CH 3 Ki = 47.0 nM 323.32 Cc1ccc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)cc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL3895144 OBDepict O N OH O F Ki = 50.0 nM 309.3 O=C(c1ccc(F)c(O)c1)c1cccc(Oc2ccccc2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL4171183 OBDepict F OH O N F OH Ki = 58.0 nM 315.27 Oc1cc(Oc2cccc(-c3cccc(O)c3F)n2)ccc1F Homo sapiens CHEMBL4155465 assay format
CHEMBL3974385 OBDepict O N OH F Ki = 63.0 nM 293.3 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccccc2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3904245 OBDepict HO HO O N F OH Ki = 64.0 nM 325.3 O=C(c1cccc(-c2cccc(O)c2F)n1)c1cccc(O)c1O Homo sapiens CHEMBL3861918 assay format
CHEMBL3968387 OBDepict OH N O F HO HO F Ki = 86.0 nM 357.31 O=C(c1ccc(F)c(O)c1)c1cc(CO)cc(-c2cccc(O)c2F)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3964826 OBDepict O N OH F S Ki = 97.0 nM 299.33 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccsc2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL4175870 OBDepict HO N O OH F Ki = 119.0 nM 283.26 O=C(c1ccc(F)c(O)c1)c1ccc2cc(O)ccc2n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3904073 OBDepict HO HO O + N _ O F OH Ki = 132.0 nM 341.29 O=C(c1cccc(O)c1O)c1cccc(-c2cccc(O)c2F)[n+]1[O-] Homo sapiens CHEMBL3861918 assay format
CHEMBL3932242 OBDepict OH O N F OH Ki = 135.0 nM 309.3 O=C(c1cccc(-c2cccc(O)c2F)n1)c1ccccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL3914131 OBDepict CH 3 N N N O OH F Ki = 190.0 nM 315.35 CN1CCN(c2cccc(C(=O)c3ccc(F)c(O)c3)n2)CC1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3946020 OBDepict O N OH F Cl F Ki = 190.0 nM 345.73 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(F)c(Cl)c2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL3975350 OBDepict F N O OH F Ki = 221.0 nM 311.29 O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(F)cc2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL1928188 OBDepict HO O N CH 3 OH Ki = 245.0 nM 305.33 Cc1cc(-c2cccc(C(=O)c3cccc(O)c3)n2)ccc1O Homo sapiens CHEMBL3861918 assay format
CHEMBL4160081 OBDepict O N H N HO F F OH Ki = 336.0 nM 342.3 O=C(Nc1ccc(F)c(O)c1)c1cccc(-c2cccc(O)c2F)n1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3924502 OBDepict O N HO HO OH F OH Ki = 405.0 nM 341.29 O=C(c1cccc(-c2cccc(O)c2F)n1)c1ccc(O)c(O)c1O Homo sapiens CHEMBL3861918 assay format
CHEMBL3983947 OBDepict O N OH N F Ki = 407.0 nM 300.33 O=C(c1ccc(F)c(O)c1)c1cccc(N2CCCCC2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL1928057 OBDepict HO O N F OH Ki = 467.0 nM 309.3 O=C(c1cccc(O)c1)c1cccc(-c2ccc(O)c(F)c2)n1 Homo sapiens CHEMBL3861918 assay format
CHEMBL4167395 OBDepict O N H N HO F F OH Ki = 686.0 nM 342.3 O=C(Nc1cccc(-c2cccc(O)c2F)n1)c1ccc(F)c(O)c1 Homo sapiens CHEMBL4155465 assay format
CHEMBL3923295 OBDepict OH F N O OH OH OH Ki = 796.0 nM 341.29 O=C(c1cccc(-c2cccc(O)c2F)n1)c1c(O)ccc(O)c1O Homo sapiens CHEMBL3861918 assay format