Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vesicular acetylcholine transporter' and Ligand = 'BDBM50009599'   

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
Vesicular acetylcholine transporter (Torpedo californica)	BDBM50009599 (4-[2-Hydroxy-3-(4-phenyl-piperidin-1-yl)-propyl]-p...) Show SMILES OC(CN1CCC(CC1)c1ccccc1)Cc1ccc(O)cc1 Show InChI InChI=1S/C20H25NO2/c22-19-8-6-16(7-9-19)14-20(23)15-21-12-10-18(11-13-21)17-4-2-1-3-5-17/h1-9,18,20,22-23H,10-15H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Displacement of [3H]-Vesamicol from Vesamicol receptor of Torpedo californica				J Med Chem 34: 2638-43 (1991) BindingDB Entry DOI: 10.7270/Q2XK8DHK
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