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Q9NPH5 | NOX4_HUMAN | NADPH oxidase 4 (NOX4)

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
CHEMBL4859206 OBDepict OH O N N F F F IC50 = 10.71 nM 306.24 Oc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)no1 Homo sapiens CHEMBL4837837 single protein format
CHEMBL1876217 OBDepict HO O N N IC50 = 16.4 nM 238.25 Oc1ccccc1-c1nc(-c2ccccc2)no1 Homo sapiens CHEMBL4837837 single protein format
CHEMBL4849098 OBDepict HO O N N IC50 = 21.94 nM 252.27 Oc1ccccc1-c1nc(Cc2ccccc2)no1 Homo sapiens CHEMBL4837837 single protein format
CHEMBL1277852 OBDepict CH 3 N N N O N N CH 3 O N H Cl Ki = 47.0 nM 488.98 CN(Cc1ccccc1)Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1ccn(C)n1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277767 OBDepict CH 3 O N N N CH 3 O N O N H Cl Ki = 65.0 nM 479.97 COc1cccc(N2CCN(Cc3c4c(=O)n(-c5ccccc5Cl)[nH]c4cc(=O)n3C)CC2)c1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 70.77 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4837837 single protein format
CHEMBL1277933 OBDepict Cl O N H 3 C O N O N H Cl Ki = 82.0 nM 430.29 Cn1c(COCc2ccccc2Cl)c2c(=O)n(-c3ccccc3Cl)[nH]c2cc1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277853 OBDepict Cl N N H O N O O N N Ki = 95.0 nM 473.92 O=c1c2c(COCc3ccccc3)n(Cc3cnccn3)c(=O)cc2[nH]n1-c1ccccc1Cl Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277934 OBDepict F O N H 3 C O N O N H Cl Ki = 114.0 nM 399.81 Cn1c(COc2ccc(F)cc2)c2c(=O)n(-c3ccccc3Cl)[nH]c2cc1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277676 OBDepict F Cl N N O H N N O N Ki = 114.0 nM 467.93 O=c1c2c(CN3CCCC3)n(CCc3ccccn3)c(=O)cc2[nH]n1-c1ccc(F)cc1Cl Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278018 OBDepict Cl N N O H N CH 3 O F Ki = 128.0 nM 369.78 Cn1c(-c2ccccc2F)c2c(=O)n(-c3ccccc3Cl)[nH]c2cc1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277677 OBDepict H 3 C N N O O N N H N Cl Ki = 151.0 nM 471.95 CN(Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1ccncc1)c1ccccc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277583 OBDepict CH 3 O N O O N O N H N F O Ki = 153.0 nM 446.48 COCCn1c(COc2ccc(F)cc2)c2c(=O)n(CCN3CCOCC3)[nH]c2cc1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278200 OBDepict Cl N N H O CH 3 N O Ki = 158.0 nM 389.84 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CC#Cc1ccccc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277582 OBDepict CH 3 O N O N N CH 3 O N H Cl F Ki = 165.0 nM 484.96 COCCCn1c(CN(C)Cc2ccccc2)c2c(=O)n(-c3ccc(F)cc3Cl)[nH]c2cc1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276946 OBDepict Cl N N H O CH 3 N O N Ki = 165.0 nM 366.81 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1242941 OBDepict OH OH N O OH OH + N OH O _ O IC50 = 170.0 nM 410.34 O=c1c2cc(O)c(O)cc2c2cc(O)c(O)cc2n1Cc1cc([N+](=O)[O-])ccc1O Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1277768 OBDepict H 3 C N N O O N N H N Cl Ki = 172.0 nM 485.98 CN(Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CCc1ccccn1)c1ccccc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277489 OBDepict CH 3 N N H O CH 3 N O N Ki = 173.0 nM 346.39 Cc1ccccc1-n1[nH]c2cc(=O)n(Cc3ccccn3)c(C)c2c1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277932 OBDepict F Cl N N H O CH 3 N O H 3 C Ki = 213.0 nM 307.71 Cc1c2c(=O)n(-c3ccc(F)cc3Cl)[nH]c2cc(=O)n1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276162 OBDepict Cl N N H O CH 3 N O H 3 C Ki = 215.0 nM 289.72 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277215 OBDepict Cl Cl N N O H CH 3 N O N Ki = 218.0 nM 415.28 Cc1c2c(=O)n(Cc3cc(Cl)ccc3Cl)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276857 OBDepict O N H N O O CH 3 N O N H F Cl Ki = 218.0 nM 442.83 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1NC(=O)COc1ccc(F)cc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278111 OBDepict CH 3 N CH 3 N O CH 3 N O N H Cl Ki = 235.0 nM 346.82 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CCN(C)C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277399 OBDepict F Cl N N H O CH 3 N O N Ki = 235.0 nM 384.8 Cc1c2c(=O)n(-c3ccc(F)cc3Cl)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277032 OBDepict Cl N N H O CH 3 N O N N O Ki = 236.0 nM 451.91 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1cccc(N2CCOCC2)n1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277850 OBDepict O N N CH 3 N O H 3 C O N Cl Ki = 240.0 nM 408.85 CC(=O)n1c2cc(=O)n(Cc3cccnc3)c(C)c2c(=O)n1-c1ccccc1Cl Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1243033 OBDepict NH 2 N H N S N H 2 N IC50 = 240.0 nM 307.38 Nc1cccc(Nc2ncnc3c2sc2ccc(N)cc23)c1 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1276945 OBDepict Cl N N H O CH 3 N O S O O NH 2 Ki = 259.0 nM 444.9 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1ccc(S(N)(=O)=O)cc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277398 OBDepict Cl N N H O CH 3 N O N Ki = 259.0 nM 380.83 Cc1c2c(=O)n(Cc3ccc(Cl)cc3)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1242942 OBDepict OH HO N O HO + N OH O _ O IC50 = 260.0 nM 394.34 O=c1c2cc(O)c(O)cc2c2cc(O)c(O)cc2n1Cc1cccc([N+](=O)[O-])c1 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1277765 OBDepict H 3 C O N O N O O N CH 3 N Ki = 285.0 nM 480.52 COc1cccc(CC(=O)n2c3cc(=O)n(Cc4cccnc4)c(C)c3c(=O)n2-c2ccccc2)c1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278017 OBDepict N N N H O CH 3 N O H 3 C Ki = 293.0 nM 280.29 Cc1c2c(=O)n(-c3cccc(C#N)c3)[nH]c2cc(=O)n1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276163 OBDepict F N N H O CH 3 N O H 3 C Ki = 308.0 nM 273.27 Cc1c2c(=O)n(-c3ccccc3F)[nH]c2cc(=O)n1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277033 OBDepict CH 3 O N N O H CH 3 N O N Ki = 313.0 nM 314.35 COCCn1[nH]c2cc(=O)n(Cc3ccccn3)c(C)c2c1=O Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277214 OBDepict Cl O N N H O CH 3 N O N Ki = 326.0 nM 410.86 Cc1c2c(=O)n(CCOc3ccc(Cl)cc3)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1275631 OBDepict CH 3 N H O N N H O CH 3 N O H 3 C Ki = 328.0 nM 312.33 CC(=O)Nc1cccc(-n2[nH]c3cc(=O)n(C)c(C)c3c2=O)c1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277124 OBDepict H N N O O N CH 3 N Ki = 334.0 nM 360.42 Cc1c2c(=O)n(CCc3ccccc3)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276222 OBDepict Cl N N H O CH 3 N O H 3 C Ki = 340.0 nM 289.72 Cc1c2c(=O)n(-c3cccc(Cl)c3)[nH]c2cc(=O)n1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277310 OBDepict F Cl N N H O CH 3 N O N Ki = 342.0 nM 398.83 Cc1c2c(=O)n(Cc3ccc(F)cc3Cl)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277122 OBDepict O N N CH 3 H N O N Ki = 373.0 nM 332.36 Cc1c2c(=O)n(-c3ccccc3)[nH]c2cc(=O)n1Cc1cccnc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1276223 OBDepict CH 3 N N H O CH 3 N O N Ki = 387.0 nM 270.29 Cc1c2c(=O)n(C)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277766 OBDepict O N N CH 3 N O H 3 C O N H 3 C Ki = 398.0 nM 388.43 CC(=O)n1c2cc(=O)n(Cc3cccnc3)c(C)c2c(=O)n1-c1ccccc1C Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277397 OBDepict O N N CH 3 N O H 3 C O N Ki = 409.0 nM 374.4 CC(=O)n1c2cc(=O)n(Cc3cccnc3)c(C)c2c(=O)n1-c1ccccc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278199 OBDepict CH 3 N N O N O CH 3 N O N H Cl Ki = 428.0 nM 443.94 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CCCC(=O)N1CCN(C)CC1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277123 OBDepict H N N O O N CH 3 N N O Ki = 445.0 nM 369.43 Cc1c2c(=O)n(CCN3CCOCC3)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277490 OBDepict Cl N N N H O CH 3 N O N Ki = 458.0 nM 417.86 Cc1c2c(=O)n(-c3ccnc4cc(Cl)ccc34)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1277309 OBDepict O N N CH 3 H N N O Ki = 463.0 nM 346.39 Cc1c2c(=O)n(Cc3ccccc3)[nH]c2cc(=O)n1Cc1ccccn1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL4208156 OBDepict H 3 C O S N O O O N F F F IC50 = 500.0 nM 400.38 COc1ccc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cc3)C2=O)cc1 Homo sapiens CHEMBL4188460 single protein format
CHEMBL1276858 OBDepict CH 3 N N N O CH 3 N O N H Cl Ki = 515.0 nM 478.0 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1Cc1ccc(CN2CCN(C)CC2)cc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278109 OBDepict O N N CH 3 H N O Cl Ki = 520.0 nM 371.87 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CC1CCCCC1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1278110 OBDepict OH N O CH 3 N O N H Cl Ki = 565.0 nM 333.78 Cc1c2c(=O)n(-c3ccccc3Cl)[nH]c2cc(=O)n1CCCO Homo sapiens CHEMBL1286959 cell-based format
CHEMBL1242968 OBDepict N N O OH HO OH HO IC50 = 590.0 nM 374.35 N#Cc1ccccc1Cn1c(=O)c2cc(O)c(O)cc2c2cc(O)c(O)cc21 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL85021 OBDepict O N H H 3 C CH 3 HO CH 3 H 3 C IC50 = 630.0 nM 321.42 CC(C)c1cc(/C=C2C(=O)Nc3ccccc32)cc(C(C)C)c1O Homo sapiens CHEMBL1249158 cell-based format
CHEMBL50 OBDepict OH OH O O HO HO HO IC50 = 680.0 nM 302.24 O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL470848 OBDepict CH 3 O OH O O HO HO HO IC50 = 740.0 nM 316.26 COc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1243032 OBDepict OH O O HO OH HO IC50 = 790.0 nM 286.24 O=c1c(-c2ccc(O)c(O)c2)c(O)oc2cc(O)ccc12 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1098724 OBDepict OH H O H OH H O H OH H HO O O OH OH HO OH IC50 = 830.0 nM 464.38 O=c1c(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL3827985 OBDepict Cl N O S N H 3 C N H 3 C CH 3 Ki = 840.0 nM 371.89 CN1C(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(N(C)C)cc1 Homo sapiens CHEMBL3829981 assay format
CHEMBL151 OBDepict OH OH O O HO HO IC50 = 850.0 nM 286.24 O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1277308 OBDepict F N N H O CH 3 N O Ki = 878.0 nM 349.37 Cc1c2c(=O)n(-c3ccc(F)cc3)[nH]c2cc(=O)n1Cc1ccccc1 Homo sapiens CHEMBL1286959 cell-based format
CHEMBL3827795 OBDepict H 3 C N CH 3 N O N H 3 C S Ki = 880.0 nM 337.45 CN1C(=S)N(c2ccccc2)C(=O)/C1=C/c1ccc(N(C)C)cc1 Homo sapiens CHEMBL3829981 assay format
CHEMBL1243187 OBDepict O N H NH O N N OH HO HO OH IC50 = 910.0 nM 358.31 O=C(N/N=C/c1cccc(O)c1O)C(=O)N/N=C/c1cccc(O)c1O Homo sapiens CHEMBL1249158 cell-based format
CHEMBL131407 OBDepict OH N H OH O OH IC50 = 960.0 nM 259.26 O=C(O)c1cc(NCc2ccccc2O)ccc1O Homo sapiens CHEMBL1249158 cell-based format
CHEMBL1243064 OBDepict H 2 C N N S CH 2 O N H CH 3 HO H 3 C IC50 = 1000.0 nM 329.43 C=CCN(CC=C)C(=S)/N=C1C(=O)Nc2cc(C)c(O)c(C)c21 Homo sapiens CHEMBL1249158 cell-based format