Reaction Details Report a problem with these data
Target
Vitamin K epoxide reductase complex subunit 1
Ligand
BDBM50166638
Substrate
n/a
Meas. Tech.
ChEMBL_305987 (CHEMBL832974)
IC50
1000±n/a nM
Citation
 Chen, DU; Kuo, PY; Yang, DY Design and synthesis of novel diphenacoum-derived, conformation-restricted vitamin K 2,3-epoxide reductase inhibitors. Bioorg Med Chem Lett 15:2665-8 (2005) [PubMed]  Article 
Target
Name:
Vitamin K epoxide reductase complex subunit 1
Synonyms:
VKOR1_BOVIN | VKORC1 | Vitamin k epoxide reductase complex subunit 1 isoform 1
Type:
PROTEIN
Mol. Mass.:
17977.60
Organism:
Bos taurus
Description:
ChEMBL_305987
Residue:
163
Sequence:
MGATWRSPGWVRLALCLAGLVLSLYALHVKAARARDRDYRALCDVGTAISCSRVFSSRWGRGFGLVEHVLGKDSILNQSNSIFGCIFYTLQLLLGCLQGRWASVLLRLSCLVSLAGSVYLAWILFFVLYDFCIVCITTYAINVGLTVLSFREVQGPQGKVKGH
  
Inhibitor
Name:
BDBM50166638
Synonyms:
13-(4-phenylphenyl)-4,12,14-trioxapentacyclo[11.7.1.0^{2,11}.0^{5,10}.0^{15,20}]henicosa-2(11),5,7,9,15(20),16,18-heptaen-3-one | CHEMBL440565
Type:
Small organic molecule
Emp. Form.:
C30H20O4
Mol. Mass.:
444.4774
SMILES:
O=c1oc2ccccc2c2OC3(CC(c4ccccc4O3)c12)c1ccc(cc1)-c1ccccc1 |THB:1:21:12:20.14.19,15:14:21.9.10:12,8:9:12:20.14.19|
Structure:
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