Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RNA-directed RNA polymerase' and Ligand = 'BDBM50199048'   

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)	BDBM50199048 (13-cyclohexyl-5-iso-propyl-6,7-dihydro-5H-benzo[5,...) Show SMILES CC(C)N1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12 Show InChI InChI=1S/C26H30N2O2/c1-17(2)27-14-15-28-23-16-19(26(29)30)12-13-20(23)24(18-8-4-3-5-9-18)25(28)21-10-6-7-11-22(21)27/h6-7,10-13,16-18H,3-5,8-9,14-15H2,1-2H3,(H,29,30)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of HCV NS5B RNA polymerase				J Med Chem 49: 6950-3 (2006) Article DOI: 10.1021/jm0610245 BindingDB Entry DOI: 10.7270/Q2XD12GM
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