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Target
Genome polyprotein [1027-1711]
Ligand
BDBM98165
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
7.8±0
Ki
39±0.0 nM
IC50
202±0.0 nM
Citation
 Farmer, LJ; Perni, RB; Pitlik, J; van Drie, Jr., JH Inhibitors of serine proteases, particularly HCV NS3-NS4A protease US Patent  US8486989 Publication Date 7/16/2013 
Target
Name:
Genome polyprotein [1027-1711]
Synonyms:
Genome polyprotein | POLG_HCV1
Type:
Protein
Mol. Mass.:
73039.46
Organism:
Hepatitis C virus (HCV)
Description:
1027-1711 aa of P26664
Residue:
685
Sequence:
APITAYAQQTRGLLGCIITSLTGRDKNQVEGEVQIVSTAAQTFLATCINGVCWTVYHGAGTRTIASPKGPVIQMYTNVDQDLVGWPAPQGSRSLTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPISYLKGSSGGPLLCPAGHAVGIFRAAVCTRGVAKAVDFIPVENLETTMRSPVFTDNSSPPVVPQSFQVAHLHAPTGSGKSTKVPAAYAAQGYKVLVLNPSVAATLGFGAYMSKAHGIDPNIRTGVRTITTGSPITYSTYGKFLADGGCSGGAYDIIICDECHSTDATSILGIGTVLDQAETAGARLVVLATATPPGSVTVPHPNIEEVALSTTGEIPFYGKAIPLEVIKGGRHLIFCHSKKKCDELAAKLVALGINAVAYYRGLDVSVIPTSGDVVVVATDALMTGYTGDFDSVIDCNTCVTQTVDFSLDPTFTIETITLPQDAVSRTQRRGRTGRGKPGIYRFVAPGERPSGMFDSSVLCECYDAGCAWYELTPAETTVRLRAYMNTPGLPVCQDHLEFWEGVFTGLTHIDAHFLSQTKQSGENLPYLVAYQATVCARAQAPPPSWDQMWKCLIRLKPTLHGPTPLLYRLGAVQNEITLTHPVTKYIMTCMSADLEVVTSTWVLVGGVLAALAAYCLSTGCVVIVGRVVLSGKPAIIPDREVLYREFDEMEEC
  
Inhibitor
Name:
BDBM98165
Synonyms:
US8486989, IA
Type:
Small organic molecule
Emp. Form.:
C38H53N7O6
Mol. Mass.:
703.8707
SMILES:
CCC[C@H](NC(=O)[C@@H]1[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1 |r,c:12|
Structure:
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