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 = 'BDBM50121748'   

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))	BDBM50121748 ((R,S)Piperidin-2-yl-(4-pyridin-2-ylmethyl-piperazi...) Show SMILES O=C(C1CCCCN1)N1CCN(Cc2ccccn2)CC1 Show InChI InChI=1S/C16H24N4O/c21-16(15-6-2-4-8-18-15)20-11-9-19(10-12-20)13-14-5-1-3-7-17-14/h1,3,5,7,15,18H,2,4,6,8-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Binding affinity towards alpha4-beta2 measured by using the inhibition of [3H]NIC binding to rat striatal membrane				Bioorg Med Chem Lett 13: 97-100 (2002) BindingDB Entry DOI: 10.7270/Q2736RF1
					More data for this Ligand-Target Pair