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Target
Genome polyprotein
Ligand
BDBM50496205
Substrate
n/a
Meas. Tech.
ChEMBL_1294624 (CHEMBL3128539)
Ki
53±n/a nM
Citation
 Lampa, AK; Bergman, SM; Gustafsson, SS; Alogheli, H; Akerblom, EB; Lindeberg, GG; Svensson, RM; Artursson, P; Danielson, UH; Karlén, A; Sandström, A Novel Peptidomimetic Hepatitis C Virus NS3/4A Protease Inhibitors Spanning the P2-P1' Region. ACS Med Chem Lett 5:249-54 (2014) [PubMed]  Article 
Target
Name:
Genome polyprotein
Synonyms:
NS3 protease
Type:
PROTEIN
Mol. Mass.:
19154.35
Organism:
Hepacivirus C
Description:
ChEMBL_118440
Residue:
181
Sequence:
APITAYAQQTRGLLGCIITSLTGRDKNQAEGEVQIVSTATQTFLATCINGVCWTVYHGAGTRTIASPKGPVIQMYTNVDKDLVGWPAPQGTRSLTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPISYLKGSSGGPLLCPAGHAVGIFRAAVCTRGVAKAVDFIPVENLETTMRS
  
Inhibitor
Name:
BDBM50496205
Synonyms:
CHEMBL3125043
Type:
Small organic molecule
Emp. Form.:
C46H47F3N6O9S
Mol. Mass.:
916.96
SMILES:
COc1cc(Oc2ccc(cc2C=C)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)Nc2cccc(c2)C(=O)NS(=O)(=O)c2ccc(cc2)C(F)(F)F)nc(n1)-c1ccccc1 |r|
Structure:
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