Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2C19' and Ligand = 'BDBM50383620'   

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
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM50383620 (CHEMBL2029648) Show SMILES OCCNC(=O)CS(=O)C1c2ccccc2-c2ccccc12 Show InChI InChI=1S/C17H17NO3S/c19-10-9-18-16(20)11-22(21)17-14-7-3-1-5-12(14)13-6-2-4-8-15(13)17/h1-8,17,19H,9-11H2,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description Inhibition of CYP2C19				Bioorg Med Chem Lett 22: 3751-3 (2012) Article DOI: 10.1016/j.bmcl.2012.04.031 BindingDB Entry DOI: 10.7270/Q2N29XZB
					More data for this Ligand-Target Pair