BDBM50158818 CHEMBL333397::{5-[4-Acetoxy-1-(4-bromo-phenyl)-but-(Z)-ylidene]-4-oxo-2-thioxo-thiazolidin-3-yl}-acetic acid::{5-[4-Acetoxy-1-(4-bromo-phenyl)-butylidene]-4-oxo-2-thioxo-thiazolidin-3-yl}-acetic acid(RD4-6205)

SMILES: CC(=O)OCCC=C(c1sc(=S)n(CC(O)=O)c1O)c1ccc(Br)cc1

InChI Key: InChIKey=BRCUEKKPIPSBOQ-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 = 50158818   

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
Hepatitis C virus serine protease, NS3/NS4A (Hepatitis C virus)	BDBM50158818 (CHEMBL333397 | {5-[4-Acetoxy-1-(4-bromo-phenyl)-bu...) Show SMILES CC(=O)OCCC=C(c1sc(=S)n(CC(O)=O)c1O)c1ccc(Br)cc1 |w:6.5| Show InChI InChI=1S/C17H16BrNO5S2/c1-10(20)24-8-2-3-13(11-4-6-12(18)7-5-11)15-16(23)19(9-14(21)22)17(25)26-15/h3-7,23H,2,8-9H2,1H3,(H,21,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wollongong Curated by ChEMBL					Assay Description Inhibitory concentration against hepatitis C virus NS3 protease				J Med Chem 48: 1-20 (2005) Article DOI: 10.1021/jm0400101 BindingDB Entry DOI: 10.7270/Q2XP75Q1
					More data for this Ligand-Target Pair