Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit alpha-4/beta-2' and Ligand = 'BDBM50114777'   

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
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50114777 (2-Chloro-3-(2-pyridin-2-yl-vinyl)-5-(pyrrolidin-2-...) Show SMILES Clc1ncc(OCC2CCCN2)cc1\C=C\c1ccccn1 Show InChI InChI=1S/C17H18ClN3O/c18-17-13(6-7-14-4-1-2-8-19-14)10-16(11-21-17)22-12-15-5-3-9-20-15/h1-2,4,6-8,10-11,15,20H,3,5,9,12H2/b7-6+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.331	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse Curated by ChEMBL					Assay Description Binding affinity for nAChR with [3H]-imidacloprid in Drosophila				J Med Chem 45: 2841-9 (2002) BindingDB Entry DOI: 10.7270/Q2FN15JT
					More data for this Ligand-Target Pair