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P27695 | APEX1_HUMAN | DNA-(apurinic or apyrimidinic site) endonuclease (APEX1)

3D structures mapped by conservation among orthologs

[ Domain: "DNase I-like" // Exo_endo_phos ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL275938 OBDepict OH O O OH HO O OH O HO IC50 = 55.0 nM 422.35 O=C(O)C1=CC(=C(c2ccc(O)c(C(=O)O)c2)c2ccc(O)c(C(=O)O)c2)C=CC1=O Homo sapiens CHEMBL4185154 single protein format
CHEMBL4210534 OBDepict O N H HN NH N H O IC50 = 55.0 nM 512.7 c1cc2ccc3cc2cc1CNCCOCCNCc1ccc2ccc(cc2c1)CNCCOCCNC3 Homo sapiens CHEMBL4185143 single protein format
CHEMBL4205402 OBDepict N H N H HN NH N H N H IC50 = 57.0 nM 510.73 c1cc2ccc3cc2cc1CNCCNCCNCc1ccc2ccc(cc2c1)CNCCNCCNC3 Homo sapiens CHEMBL4185143 single protein format
CHEMBL22077 OBDepict H 3 C N CH 3 HN S O HO IC50 = 80.0 nM 356.49 CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12 Homo sapiens CHEMBL4185157 assay format
CHEMBL109037 OBDepict OH O H 2 N OH OH HO IC50 = 110.0 nM 213.19 NC(Cc1cc(O)c(O)cc1O)C(=O)O Homo sapiens CHEMBL3389217 single protein format
CHEMBL4205950 OBDepict S N S O O _ O S O O _ O HN O CH 3 + Na + Na IC50 = 250.0 nM 498.47 CC(=O)Nc1ccc(/C=C/c2ccc(N=C=S)c(S(=O)(=O)[O-])c2)c(S(=O)(=O)[O-])c1.[Na+].[Na+] Homo sapiens CHEMBL4185152 single protein format
CHEMBL56393 OBDepict N O OH HO OH HO IC50 = 280.0 nM 297.27 N#C/C(=Cc1ccc(O)c(O)c1)C(=O)c1ccc(O)c(O)c1 Homo sapiens CHEMBL4185153 single protein format
CHEMBL164 OBDepict OH OH O O HO HO OH HO IC50 = 320.0 nM 318.24 O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12 Homo sapiens CHEMBL3389217 single protein format
CHEMBL1601846 OBDepict OH O O O O OH HO HO IC50 = 400.0 nM 278.17 O=c1oc2c(cc1O)oc(=O)c1cc(O)c(O)c(O)c12 Homo sapiens CHEMBL4185149 single protein format
CHEMBL1346456 OBDepict H 3 C O OH OH O O H 3 C CH 3 IC50 = 400.0 nM 300.31 COc1cc2c(ccc3cc(OC)c(OC)c(O)c32)cc1O Homo sapiens CHEMBL4185149 single protein format
CHEMBL1256623 OBDepict O N N CH 3 HO OH IC50 = 500.0 nM 168.15 CN(N=O)c1ccc(O)c(O)c1 Homo sapiens CHEMBL4185153 single protein format
CHEMBL4211672 OBDepict O O S Cl CH 3 CH 3 H 3 C CH 3 CH 3 CH 3 IC50 = 800.0 nM 400.97 CC(C)(C)c1ccc(OC(=O)c2sc3ccccc3c2Cl)c(C(C)(C)C)c1 Homo sapiens CHEMBL4185144 cell-based format
CHEMBL4203747 OBDepict Cl N H Cl S N H 3 C F IC50 = 900.0 nM 429.35 Cc1sc(Nc2cc(Cl)cc(Cl)c2)nc1-c1ccc(-c2ccccc2F)cc1 Homo sapiens CHEMBL4185144 cell-based format
CHEMBL568994 OBDepict HO O CH 3 Cl O O IC50 = 1000.0 nM 276.67 C/C(=CC1=C(Cl)C(=O)c2ccccc2C1=O)C(=O)O Homo sapiens CHEMBL1043577 cell-based format
CHEMBL399043 OBDepict CH 2 H 3 C H 3 C S OH O H 3 C IC50 = 1000.0 nM 210.3 C=C/C(C)=C/[C@@]1(C)SC(=O)C(C)=C1O Homo sapiens CHEMBL4185153 single protein format
CHEMBL1706858 OBDepict CH 3 NH O S N S N H IC50 = 1000.0 nM 315.42 CC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CNC2 Homo sapiens CHEMBL2061059 single protein format
CHEMBL570294 OBDepict OH NH O CH 3 Cl O O IC50 = 1000.0 nM 319.74 C/C(=CC1=C(Cl)C(=O)c2ccccc2C1=O)C(=O)NCCO Homo sapiens CHEMBL1043577 cell-based format
CHEMBL570293 OBDepict H 3 C O O OH Br O O IC50 = 1000.0 nM 365.18 COCC/C(=CC1=C(Br)C(=O)c2ccccc2C1=O)C(=O)O Homo sapiens CHEMBL1043577 cell-based format
CHEMBL572060 OBDepict H 3 C S O O CH 3 O OH IC50 = 1000.0 nM 288.32 CSC1=C(/C=C(C)C(=O)O)C(=O)c2ccccc2C1=O Homo sapiens CHEMBL1043577 cell-based format
CHEMBL577297 OBDepict H 3 C O O O CH 3 O OH IC50 = 1000.0 nM 272.26 COC1=C(/C=C(C)C(=O)O)C(=O)c2ccccc2C1=O Homo sapiens CHEMBL1043577 cell-based format