Reaction Details
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Genome polyprotein [1027-1207,D168A]
Ligand
BDBM241943
Substrate
n/a
Meas. Tech.
FRET Assay
pH
7.5±n/a
IC50
508±n/a nM
Comments
extracted
Citation
Niu, D; Petter, RC; Qiao, L; Singh, J HCV protease inhibitors and uses thereof US Patent US9422333 Publication Date 8/23/2016 More Info.:
Target
Name:
Genome polyprotein [1027-1207,D168A]
Synonyms:
POLG_HCV1 | Protease NS3/Non-structural protein 4A (NS3/NS4A) (D168A)
Type:
Enzyme
Mol. Mass.:
19078.30
Organism:
Hepatitis C virus genotype 1b (isolate Con1) (HCV)
Description:
P26664[1027-1207,D168A]
Residue:
181
Sequence:
APITAYAQQTRGLLGCIITSLTGRDKNQVEGEVQIVSTAAQTFLATCINGVCWTVYHGAGTRTIASPKGPVIQMYTNVDQDLVGWPAPQGARSLTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPISYLKGSSGGPLLCPAGHAVGLFRAAVCTRGVAKAVAFIPVENLETTMRS
Inhibitor
Name:
BDBM241943
Synonyms:
US9422333, I-23
Type:
Small organic molecule
Emp. Form.:
C38H51F3N8O8
Mol. Mass.:
804.8555
SMILES:
CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@H](CNC(=O)C=C)NC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(OC(=O)C(F)(F)F)C(=O)NC1CC1 |r,w:43.47|
Structure:
