Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vesicular acetylcholine transporter' and Ligand = 'BDBM50046961'   

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 (Homo sapiens (Human))	BDBM50046961 ((3'R,4'R)-4-Phenyl-[1,3']bipiperidinyl-4'-ol | CHE...) Show SMILES O[C@@H]1CCNC[C@H]1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C16H24N2O/c19-16-6-9-17-12-15(16)18-10-7-14(8-11-18)13-4-2-1-3-5-13/h1-5,14-17,19H,6-12H2/t15-,16-/m1/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+3	n/a	n/a	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 Vesicular Acetylcholine Transporter (VAChT)				J Med Chem 42: 2862-9 (1999) Article DOI: 10.1021/jm980560x BindingDB Entry DOI: 10.7270/Q2542MS2
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Torpedo californica)	BDBM50046961 ((3'R,4'R)-4-Phenyl-[1,3']bipiperidinyl-4'-ol | CHE...) Show SMILES O[C@@H]1CCNC[C@H]1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C16H24N2O/c19-16-6-9-17-12-15(16)18-10-7-14(8-11-18)13-4-2-1-3-5-13/h1-5,14-17,19H,6-12H2/t15-,16-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Inhibition of [3H]- vesamicol binding to synaptic vesicles preparation from the electric organ of Torpedo californica				J Med Chem 36: 985-9 (1993) BindingDB Entry DOI: 10.7270/Q2R49RDQ
					More data for this Ligand-Target Pair