Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RNA-directed RNA polymerase' and Ligand = 'BDBM50176308'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50176308 (CHEMBL383596 | ethyl 6-methyl-2-(3-tosylureido)-4,...) Show SMILES CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CC(C)CCc12 Show InChI InChI=1S/C20H24N2O5S2/c1-4-27-19(23)17-15-10-7-13(3)11-16(15)28-18(17)21-20(24)22-29(25,26)14-8-5-12(2)6-9-14/h5-6,8-9,13H,4,7,10-11H2,1-3H3,(H2,21,22,24)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
ViroPharma Inc Curated by ChEMBL					Assay Description Inhibitory activity against HCV 4a NS5B full length RNA dependent RNA polymerase				Bioorg Med Chem Lett 16: 100-3 (2005) Article DOI: 10.1016/j.bmcl.2005.09.047 BindingDB Entry DOI: 10.7270/Q2M32VBT
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