BDBM50174463 (Z)-4-[1-(Butane-1-sulfonyl)-3-(4-chloro-benzyl)-piperidin-3-yl]-2-hydroxy-4-oxo-but-2-enoic acid::CHEMBL197953

SMILES: CCCCS(=O)(=O)N1CCCC(Cc2ccc(Cl)cc2)(C1)C(=O)CC(=O)C(O)=O

InChI Key: InChIKey=CFMMNDSPDHMKEK-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 = 50174463   

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 NS5B RNA-dependent RNA polymerase (Hepatitis C virus)	BDBM50174463 ((Z)-4-[1-(Butane-1-sulfonyl)-3-(4-chloro-benzyl)-p...) Show SMILES CCCCS(=O)(=O)N1CCCC(Cc2ccc(Cl)cc2)(C1)C(=O)CC(=O)C(O)=O Show InChI InChI=1S/C20H26ClNO6S/c1-2-3-11-29(27,28)22-10-4-9-20(14-22,18(24)12-17(23)19(25)26)13-15-5-7-16(21)8-6-15/h5-8H,2-4,9-14H2,1H3,(H,25,26)	UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.14E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Rome La Sapienza Curated by ChEMBL					Assay Description Inhibitory concentration against NS5B HCV polymerase using [alpha-32P]UTP as radioligand (30 degree C for 2 h, at pH 7.5 with Tris-HCl buffer)				J Med Chem 48: 6304-14 (2005) Article DOI: 10.1021/jm0504454 BindingDB Entry DOI: 10.7270/Q2T43SNM
					More data for this Ligand-Target Pair