Target
Genome polyprotein
Ligand
BDBM55028
Substrate
n/a
Meas. Tech.
Fluorescence-based biochemical high throughput dose response assay for inhibitors of the Hepatitis C Virus non-structural protein 3 helicase (NS3).
IC50
11237±n/a nM
Citation
 PubChem, PC Fluorescence-based biochemical high throughput dose response assay for inhibitors of the Hepatitis C Virus non-structural protein 3 helicase (NS3). PubChem Bioassay (2009)[AID] 
Target
Name:
Genome polyprotein
Synonyms:
NS3
Type:
Enzyme Catalytic Domain
Mol. Mass.:
67067.41
Organism:
Hepatitis C virus
Description:
gi_125541954
Residue:
631
Sequence:
APITAYAQQTRGLLGCIITGLTGRDKNQVEGEVQIVSTAAQTFLATCINGVCWTVYHGAGTRTIASSKGPVIQMYTNVDQDLVGWPAPQGARSLTPCTCGSSDLYLVTRHADVIPVRRRGDGRGSLLSPRPISYLKGSSGGPLLCPAGHAVGIFRAAVCTRGVAKAVDFIPVEGLETTMRSPVFSDNSSPPAVPQSYQVAHLHAPTGSGKSTKVPAAYAAQGYKVLVLNPSVAATLGFGAYMSKAHGIDPNIRTGVRTITTGSPITYSTYGKFLADGGCSGSAYDIIICDECHSTDATSILGIGTVLDQAETAGARLTVLATATPPGSVTVPHPNIEEVALSTTGEIPFYGKAIPLEAIKGGRHLIFCHSKKKCDELAAKLVALGVNAVAYYRGLDVSVIPASGDVVVVATDALMTGFTGDFDSVIDCNTCVTQTVDFSLDPTFTIETTTLPQDAVSRTQRRGRTGRGKPGIYRFVTPGERPSGMFDSSVLCECYDAGCAWYELTPAETTVRLRAYMNTPGLPVCQDHLEFWEGVFTGLTHIDAHFLSQTKQSGENLPYLVAYQATVCARAQAPPPSWDQMWKCLIRLKPTLHGPTPLLYRLGAVQNEITLTHPITKYIMTCMSADLEVVT
  
Inhibitor
Name:
BDBM55028
Synonyms:
MLS000587332 | N-(4-keto-6,6-dimethyl-2-nonyl-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitro-benzamide | N-(6,6-Dimethyl-2-nonyl-4-oxo-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2-nitro-benzamide | N-(6,6-dimethyl-2-nonyl-4-oxidanylidene-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitro-benzamide | N-(6,6-dimethyl-2-nonyl-4-oxo-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitrobenzamide | SMR000211350 | cid_1601813
Type:
Small organic molecule
Emp. Form.:
C27H34N4O5S
Mol. Mass.:
526.648
SMILES:
CCCCCCCCCc1nc2sc3COC(C)(C)Cc3c2c(=O)n1NC(=O)c1ccccc1[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: