BDBM65592 US9693997, 10

SMILES: CC(C)(C)N1Cc2ccc(cc2S1(=O)=O)-c1c(Cl)cc(Nc2n[nH]c(N)n2)cc1C(F)(F)F

InChI Key: InChIKey=IOJUDVFVVGDWOS-UHFFFAOYSA-N

Data: 1 EC50

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 = 65592   

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
HCV NS3-NS4A Serine Proteinase (Hepatitis C virus (HCV genotype 1a, isolate H))	BDBM65592 (US9693997, 10) Show SMILES CC(C)(C)N1Cc2ccc(cc2S1(=O)=O)-c1c(Cl)cc(Nc2n[nH]c(N)n2)cc1C(F)(F)F Show InChI InChI=1S/C20H20ClF3N6O2S/c1-19(2,3)30-9-11-5-4-10(6-15(11)33(30,31)32)16-13(20(22,23)24)7-12(8-14(16)21)26-18-27-17(25)28-29-18/h4-8H,9H2,1-3H3,(H4,25,26,27,28,29)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
HOFFMANN-LA ROCHE INC. US Patent					Assay Description Plasmids expressing HCV E1 and E2 envelope proteins of GT1a H77 strain (Proc Natl Acad Sci USA 1997 94:8738-43) or GT1b Con1 strain (Science 1999 285...				US Patent US9693997 (2017) BindingDB Entry DOI: 10.7270/Q2833Q56
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