Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit alpha-7' and Ligand = 'BDBM50530222'   

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))	BDBM50530222 (CHEMBL4440670) Show SMILES [H][C@@]12CC[C@@]([H])(C1)[C@H]([C@@H]2NC)c1ccc(Cl)nc1 |r,TLB:9:8:2.3:6,THB:11:7:2.3:6| Show InChI InChI=1S/C13H17ClN2/c1-15-13-9-3-2-8(6-9)12(13)10-4-5-11(14)16-7-10/h4-5,7-9,12-13,15H,2-3,6H2,1H3/t8-,9+,12-,13+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Displacement of [3H]-methyllycaconitine from alpha7* nAChR in rat brain P2 membranes after 2.5 hrs by liquid scintillation spectrometry				J Med Chem 62: 1887-1901 (2019) Article DOI: 10.1021/acs.jmedchem.8b01372 BindingDB Entry DOI: 10.7270/Q2PR80F8
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Rattus norvegicus (Rat))	BDBM50530222 (CHEMBL4440670) Show SMILES [H][C@@]12CC[C@@]([H])(C1)[C@H]([C@@H]2NC)c1ccc(Cl)nc1 |r,TLB:9:8:2.3:6,THB:11:7:2.3:6| Show InChI InChI=1S/C13H17ClN2/c1-15-13-9-3-2-8(6-9)12(13)10-4-5-11(14)16-7-10/h4-5,7-9,12-13,15H,2-3,6H2,1H3/t8-,9+,12-,13+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Displacement of [3H]-methyllycaconitine from alpha7* nAChR in rat brain P2 membranes after 2.5 hrs by liquid scintillation spectrometry				J Med Chem 62: 1887-1901 (2019) Article DOI: 10.1021/acs.jmedchem.8b01372 BindingDB Entry DOI: 10.7270/Q2PR80F8
					More data for this Ligand-Target Pair