Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M2' and Ligand = 'BDBM50176727'   

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
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50176727 (3-(3-methoxyquinuclidin-3-yl)-1-phenyl-1-(pyridazi...) Show SMILES COC1(CN2CCC1CC2)C#CC(O)(c1ccccc1)c1cccnn1 |THB:1:2:5.6:9.8,(-4.65,-34.66,;-3.11,-34.63,;-2.3,-35.95,;-1.74,-37.23,;-.45,-36.17,;1.04,-36.41,;.39,-35.14,;-1.07,-34.93,;-1.45,-33.34,;-.72,-34.28,;-3.64,-36.74,;-4.97,-37.53,;-6.29,-38.32,;-7.08,-37,;-7.62,-39.11,;-8.97,-38.35,;-10.29,-39.14,;-10.27,-40.69,;-8.92,-41.44,;-7.6,-40.65,;-5.51,-39.64,;-3.98,-39.62,;-3.19,-40.95,;-3.94,-42.28,;-5.48,-42.31,;-6.27,-40.99,)| Show InChI InChI=1S/C21H23N3O2/c1-26-20(16-24-14-9-17(20)10-15-24)11-12-21(25,18-6-3-2-4-7-18)19-8-5-13-22-23-19/h2-8,13,17,25H,9-10,14-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UCB Pharma Curated by ChEMBL					Assay Description Binding affinity to human muscarinic M2 receptor				Bioorg Med Chem Lett 16: 373-7 (2005) Article DOI: 10.1016/j.bmcl.2005.09.079 BindingDB Entry DOI: 10.7270/Q2T72J70
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