Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit alpha-7' and Ligand = 'BDBM50259946'   

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-7 (Homo sapiens (Human))	BDBM50259946 (CHEMBL4069408) Show SMILES CCN1C(Nc2nc3ccc(OC)cc3s2)=NCC11CN2CCC1CC2 |c:17,THB:2:18:21.22:24.25,(5.54,-38.61,;5.06,-40.07,;6.09,-41.22,;7.62,-41.06,;8.39,-39.72,;9.93,-39.73,;10.84,-40.96,;12.3,-40.49,;13.63,-41.26,;14.97,-40.49,;14.97,-38.94,;16.29,-38.16,;16.29,-36.62,;13.63,-38.17,;12.3,-38.94,;10.84,-38.47,;8.24,-42.46,;7.1,-43.49,;5.77,-42.72,;5.56,-44.1,;3.65,-43.3,;2.25,-44.22,;2.59,-42.83,;4.29,-42.08,;4.23,-40.44,;3.64,-41.83,)| Show InChI InChI=1S/C19H25N5OS/c1-3-24-17(20-11-19(24)12-23-8-6-13(19)7-9-23)22-18-21-15-5-4-14(25-2)10-16(15)26-18/h4-5,10,13H,3,6-9,11-12H2,1-2H3,(H,20,21,22)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Agonist activity at alpha7 nAChR (unknown origin) expressed in HEK293 cells assessed as increase in calcium influx by Fluo-4-AM dye based FLIPR assay				Bioorg Med Chem Lett 27: 578-581 (2017) Article DOI: 10.1016/j.bmcl.2016.12.014 BindingDB Entry DOI: 10.7270/Q28P62ZN
					More data for this Ligand-Target Pair