Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit alpha-7' and Ligand = 'BDBM50259914'   

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 (Rattus norvegicus (Rat))	BDBM50259914 (CHEMBL4060728) Show SMILES CN1C(Nc2nc3ccccc3s2)=NCC11CN2CCC1CC2 |c:14,THB:1:15:18.19:21.22,(31.55,-31,;32.58,-32.15,;34.11,-31.99,;34.88,-30.66,;36.42,-30.66,;37.33,-31.89,;38.79,-31.42,;40.13,-32.19,;41.46,-31.42,;41.46,-29.87,;40.12,-29.1,;38.79,-29.87,;37.33,-29.4,;34.74,-33.39,;33.59,-34.42,;32.26,-33.65,;32.05,-35.04,;30.14,-34.23,;28.74,-35.16,;29.09,-33.76,;30.78,-33.01,;30.72,-31.37,;30.13,-32.76,)| Show InChI InChI=1S/C17H21N5S/c1-21-15(20-16-19-13-4-2-3-5-14(13)23-16)18-10-17(21)11-22-8-6-12(17)7-9-22/h2-5,12H,6-11H2,1H3,(H,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Agonist activity at rat alpha7 nAChR expressed in HEK293 cells co-expressing human RIC-3 assessed as area under current curve at holding potential of...				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
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50259914 (CHEMBL4060728) Show SMILES CN1C(Nc2nc3ccccc3s2)=NCC11CN2CCC1CC2 |c:14,THB:1:15:18.19:21.22,(31.55,-31,;32.58,-32.15,;34.11,-31.99,;34.88,-30.66,;36.42,-30.66,;37.33,-31.89,;38.79,-31.42,;40.13,-32.19,;41.46,-31.42,;41.46,-29.87,;40.12,-29.1,;38.79,-29.87,;37.33,-29.4,;34.74,-33.39,;33.59,-34.42,;32.26,-33.65,;32.05,-35.04,;30.14,-34.23,;28.74,-35.16,;29.09,-33.76,;30.78,-33.01,;30.72,-31.37,;30.13,-32.76,)| Show InChI InChI=1S/C17H21N5S/c1-21-15(20-16-19-13-4-2-3-5-14(13)23-16)18-10-17(21)11-22-8-6-12(17)7-9-22/h2-5,12H,6-11H2,1H3,(H,18,19,20)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	170	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