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TargetGenome polyprotein/Non-structural protein 4A
LigandBDBM50143467
Substrate/Competitorn/a
Meas. Tech.ChEMBL_143636 (CHEMBL752796)
Ki 250±n/a nM
Citation Perni, RBFarmer, LJCottrell, KMCourt, JJCourtney, LFDeininger, DDGates, CAHarbeson, SLKim, JLLin, CLin, KLuong, YPMaxwell, JPMurcko, MAPitlik, JRao, BGSchairer, WCTung, RDVan Drie, JHWilson, KThomson, JA Inhibitors of hepatitis C virus NS3.4A protease. Part 3: P2 proline variants. Bioorg Med Chem Lett14:1939-42 (2004) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Genome polyprotein/Non-structural protein 4A
Name:Genome polyprotein/Non-structural protein 4A
Synonyms:Hepatitis C virus serine protease, NS3/NS4A
Type:n/a
Mol. Mass.:n/a
Description:ASSAY_ID of ChEMBL is 1969955
Components:This complex has 2 components.
Component 1
Name:Non-structural protein 4A
Synonyms:Hepatitis C virus NS4A protein | Hepatitis C virus serine protease, NS3/NS4A | Non-structural protein 4A
Type:PROTEIN
Mol. Mass.:5762.65
Organism:Hepatitis C virus
Description:ChEMBL_305334
Residue:54
Sequence:
STWVLLGGVLAALAAYCLSVGCVVIVGYIELGGKPALVPDKEVCYQQYDEMEEC
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Component 2
Name:Genome polyprotein
Synonyms:Hepatitis C virus NS3 protease/helicase | Hepatitis C virus serine protease, NS3/NS4A
Type:Protein
Mol. Mass.:67067.41
Organism:Hepatitis C virus
Description:A3EZI9
Residue:631
Sequence:
APITAYAQQTRGLLGCIITSLTGRDKNQVEGEVQIVSTAAQTFLATCINGVCWTVYHGAG
TRTIASSKGPVIQMYTNVDQDLVGWPAPQGARSLTPCTCGSSDLYLVTRHADVIPVRRRG
DGRGSLLSPRPISYLKGSSGGPLLCPAGHAVGIFRAAVCTRGVAKAVDFIPVEGLETTMR
SPVFSDNSSPPAVPQSYQVAHLHAPTGSGKSTKVPAAYAAQGYKVLVLNPSVAATLGFGA
YMSKAHGIDPNIRTGVRTITTGSPITYSTYGKFLADGGCSGGAYDIIICDECHSTDATSI
LGIGTVLDQAETAGARLTVLATATPPGSVTVPHPNIEEVALSTTGEIPFYGKAIPLEAIK
GGRHLIFCHSKKKCDELAAKLVALGVNAVAYYRGLDVSVIPASGDVVVVATDALMTGFTG
DFDSVIDCNTCVTQTVDFSLDPTFTIETTTLPQDAVSRTQRRGRTGRGKPGIYRFVTPGE
RPSGMFDSSVLCECYDAGCAWYELTPAETTVRLRAYMNTPGLPVCQDHLEFWEGVFTGLT
HIDAHFLSQTKQSGENLPYLVAYQATVCARAQAPPPSWDQMWKCLIRLKPTLHGPTPLLY
RLGAVQNEITLTHPITKYIMTCMSADLEVVT
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BDBM50143467
n/a
NameBDBM50143467
Synonyms:(4S,5R)-1-((R)-2-{2-Cyclohexyl-2-[(hydroxy-pyrazin-2-yl-methyl)-amino]-acetylamino}-3,3-dimethyl-butyryl)-3-cyclopentyl-pyrrolidine-2-carboxylic acid [1-((S)-(R)-cyclopropylaminooxalyl)-butyl]-amide | CHEMBL427489
TypeSmall organic molecule
Emp. Form.C38H59N7O6
Mol. Mass.709.9184
SMILESCCC[C@H](NC(=O)[C@@H]1[C@H](CCN1C(=O)[C@H](NC(=O)[C@H](NC(O)c1cnccn1)C1CCCCC1)C(C)(C)C)C1CCCC1)C(=O)C(=O)NC1CC1
Structure
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