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Target
Genome polyprotein
Ligand
BDBM50482348
Substrate
n/a
Meas. Tech.
ChEMBL_642270 (CHEMBL1177150)
Ki
530±n/a nM
Citation
 Lampa, A; Ehrenberg, AE; Gustafsson, SS; Vema, A; Kerblom, E; Lindeberg, G; Karlén, A; Danielson, UH; Sandström, A Improved P2 phenylglycine-based hepatitis C virus NS3 protease inhibitors with alkenylic prime-side substituents. Bioorg Med Chem 18:5413-24 (2010) [PubMed]  Article 
Target
Name:
Genome polyprotein
Synonyms:
Protease NS3/Non-structural protein 4A (NS3/NS4A) | Protease NS3/Non-structural protein 4A (NS3/NS4A) (D168V)
Type:
Enzyme
Mol. Mass.:
19121.30
Organism:
Hepatitis C virus genotype 1b (isolate Con1) (HCV)
Description:
Q91RS4
Residue:
181
Sequence:
APITAYAQQTRGLLGCIITSLTGRDKNQVEGEVQIVSTAAQTFLATCINGVCWTVYHGAGTRTIASPKGPVIQMYTNVDQDLVGWPAPQGARSLTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPISYLKGSSGGPLLCPAGHAVGLFRAAVCTRGVAKAVDFIPVENLETTMRS
  
Inhibitor
Name:
BDBM50482348
Synonyms:
CHEMBL1170411
Type:
Small organic molecule
Emp. Form.:
C48H61N5O9S
Mol. Mass.:
884.091
SMILES:
CCC[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(Oc2cc(nc3cc(OC)ccc23)-c2ccccc2)c(C=C)c1)C(=O)NS(=O)(=O)CCCCC=C |r|
Structure:
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