BDBM183545 US9145354, 179

SMILES: CCC(NC(C)(C)CO)c1ccc(Cl)c(C(=O)c2ccccc2)c1F

InChI Key: InChIKey=LPLQRYIISFJDKD-UHFFFAOYSA-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 = 183545   

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))	BDBM183545 (US9145354, 179) Show SMILES CCC(NC(C)(C)CO)c1ccc(Cl)c(C(=O)c2ccccc2)c1F Show InChI InChI=1S/C20H23ClFNO2/c1-4-16(23-20(2,3)12-24)14-10-11-15(21)17(18(14)22)19(25)13-8-6-5-7-9-13/h5-11,16,23-24H,4,12H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	25
ASTEX THERAPEUTICS LIMITED US Patent					Assay Description The HCV NS3 protease functions have been extensively studied and are considered as potential targets for antiviral therapy: see for example the many ...				US Patent US9145354 (2015) BindingDB Entry DOI: 10.7270/Q2VH5MMZ
					More data for this Ligand-Target Pair