Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein [1027-1657]' and Ligand = 'BDBM97786'   

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))	BDBM97786 (US8476225, 47) Show SMILES COc1cccc(c1)-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/C38H49N5O8S/c1-6-26-21-38(26,35(46)41-52(48,49)30-18-19-30)40-33(44)31-22-42(27-16-14-24(15-17-27)25-10-9-13-29(20-25)50-5)23-43(31)34(45)32(37(2,3)4)39-36(47)51-28-11-7-8-12-28/h6,9-10,13-17,20,26,28,30-32H,1,7-8,11-12,18-19,21-23H2,2-5H3,(H,39,47)(H,40,44)(H,41,46)/t26-,31+,32-,38-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	110	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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