P07237 | PDIA1_HUMAN | Protein disulfide-isomerase (P4HB)

Pfam Domain Table

AccessionDomainRangeColor
PF00085Thioredoxin - Thioredoxin26~131
PF00085Thioredoxin - Thioredoxin369~471
PF13848Thioredoxin_6 - Thioredoxin-like domain161~344

3D structures mapped by conservation among orthologs

[ Domain: "Thioredoxin-like" // Thioredoxin ]

 PyMOL session

[ Domain: "Thioredoxin-like" // Thioredoxin_6_N ]

 PyMOL session

[ Domain: "Thioredoxin-like" // Thioredoxin_6_C ]

 PyMOL session


[ Alpha Fold Model ] (go)



Known binders annotated in ChEMBL

 IC50 CSV
Only the first 20 rows are shown.
molecule_chembl_idstructureassay_typerelation valueunitmol_wtsmilesorganism assay_chembl_idbao_label
CHEMBL4748449 IC50 = 23.0 nM 341.36 Oc1cc2c(cc1C(c1ccc3c(c1)OCO3)N1CCCC1)OCO2 Homo sapiens CHEMBL4729810 assay format
CHEMBL4786482 IC50 = 72.0 nM 364.36 Oc1cc2c(cc1C(Nc1ccccn1)c1ccc3c(c1)OCO3)OCO2 Homo sapiens CHEMBL4729810 assay format
CHEMBL1369923 IC50 = 92.0 nM 347.8 Oc1cc2c(cc1C(c1ccc(Cl)cc1)N1CCOCC1)OCO2 Homo sapiens CHEMBL4729810 assay format
CHEMBL3741464 IC50 = 110.0 nM 326.4 Oc1c(C(Nc2ccccc2)c2ccccc2)ccc2cccnc12 Homo sapiens CHEMBL4729810 assay format
CHEMBL4483086 IC50 = 120.0 nM 282.3 COC(=O)c1cccc(/C=C/C(=O)c2cccc(O)c2)c1 Homo sapiens CHEMBL4390738 assay format
CHEMBL1319324 IC50 = 130.0 nM 343.38 COc1ccc(C(c2cc3c(cc2O)OCO3)N2CCOCC2)cc1 Homo sapiens CHEMBL4729810 assay format
CHEMBL4472710 IC50 = 130.0 nM 375.22 COC(=O)c1cccc(/C=C/C(=O)c2ccc(CO)c(Br)c2)c1 Homo sapiens CHEMBL4390738 assay format
CHEMBL4740031 IC50 = 140.0 nM 359.4 Cc1ccnc(NC(c2ccc(F)cc2)c2ccc3cccnc3c2O)c1 Homo sapiens CHEMBL4729810 assay format
CHEMBL3703646 IC50 = 150.0 nM 387.44 COc1ccc(C(Nc2cc(C)ccn2)c2ccc3cccnc3c2O)cc1O Homo sapiens CHEMBL4729810 assay format
CHEMBL1688556 IC50 = 150.0 nM 371.4 O=[N+]([O-])c1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1 Homo sapiens CHEMBL4729810 assay format
CHEMBL4459949 IC50 = 160.0 nM 452.62 CCCCCN(CCCCC)S(=O)(=O)c1ccc(C(=O)/C=C/c2cccc(C#N)c2)cc1 Homo sapiens CHEMBL4390738 assay format
CHEMBL590899 IC50 = 170.0 nM 361.83 Oc1c(C(Nc2ccccn2)c2ccc(Cl)cc2)ccc2cccnc12 Homo sapiens CHEMBL4729810 assay format
CHEMBL4780610 IC50 = 170.0 nM 396.4 COc1cc(C(Nc2ccccn2)c2cc3c(cc2O)OCO3)cc(OC)c1O Homo sapiens CHEMBL4729810 assay format
CHEMBL591855 IC50 = 170.0 nM 355.44 CCc1ccc(C(Nc2ccccn2)c2ccc3cccnc3c2O)cc1 Homo sapiens CHEMBL4729810 assay format
CHEMBL4790355 IC50 = 180.0 nM 417.47 COc1cc(C(Nc2ccc(C)cn2)c2ccc3cccnc3c2O)cc(OC)c1O Homo sapiens CHEMBL4729810 assay format
CHEMBL1557864 IC50 = 180.0 nM 387.43 COc1cc(C(c2cc3c(cc2O)OCO3)N2CCCC2)cc(OC)c1OC Homo sapiens CHEMBL4729810 assay format
CHEMBL600752 IC50 = 190.0 nM 369.47 Cc1cc(C)c(C(Nc2ccccn2)c2ccc3cccnc3c2O)c(C)c1 Homo sapiens CHEMBL4729810 assay format
CHEMBL1536119 IC50 = 190.0 nM 417.93 CCOC(=O)C1(CCOc2ccccc2)CCN(Cc2ccc(O)c(Cl)c2)CC1 Homo sapiens CHEMBL4257297 assay format
CHEMBL4753606 IC50 < 200.0 nM 308.38 Oc1c(C(c2ccncc2)N2CCCCC2)ccc2ccoc12 Homo sapiens CHEMBL4729810 assay format
CHEMBL4776896 IC50 < 200.0 nM 387.38 Oc1c(C(c2ccc3c(c2)OC(F)(F)O3)N2CCCCC2)ccc2ccoc12 Homo sapiens CHEMBL4729810 assay format