BDBM97772 US8476225, 33

SMILES: CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-n1cccn1

InChI Key: InChIKey=CSJHUQMKDMQCTA-DNEXTIKPSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 97772   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM97772 (US8476225, 33) Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-n1cccn1 |r| Show InChI InChI=1S/C34H45N7O7S/c1-5-22-19-34(22,31(44)38-49(46,47)26-15-16-26)37-29(42)27-20-39(23-11-13-24(14-12-23)41-18-8-17-35-41)21-40(27)30(43)28(33(2,3)4)36-32(45)48-25-9-6-7-10-25/h5,8,11-14,17-18,22,25-28H,1,6-7,9-10,15-16,19-21H2,2-4H3,(H,36,45)(H,37,42)(H,38,44)/t22-,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	9	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
					More data for this Ligand-Target Pair