Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein [1027-1657]' and Ligand = 'BDBM97775'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Genome polyprotein [1027-1657] (Hepatitis C virus genotype 1a (isolate 1) (HCV))	BDBM97775 (US8476225, 36) Show SMILES CC(C)c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C34H49N5O7S/c1-7-23-18-34(23,31(42)37-47(44,45)26-16-17-26)36-29(40)27-19-38(24-14-12-22(13-15-24)21(2)3)20-39(27)30(41)28(33(4,5)6)35-32(43)46-25-10-8-9-11-25/h7,12-15,21,23,25-28H,1,8-11,16-20H2,2-6H3,(H,35,43)(H,36,40)(H,37,42)/t23-,27+,28-,34-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.5	37
Gilead Sciences, Inc. US Patent					Assay Description Inhibition assay using HCV protease.				US Patent US8476225 (2013) BindingDB Entry DOI: 10.7270/Q2M32TD9
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