Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50345677'   

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 M3 (Homo sapiens (Human))	BDBM50345677 (2-(endo-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1-...) Show SMILES CN1[C@@H]2CC[C@@H]1CC(CC(O)(c1ccccc1)c1ccccn1)C2 |r,TLB:0:1:7.23.6:3.4,THB:8:7:1:3.4| Show InChI InChI=1S/C21H26N2O/c1-23-18-10-11-19(23)14-16(13-18)15-21(24,17-7-3-2-4-8-17)20-9-5-6-12-22-20/h2-9,12,16,18-19,24H,10-11,13-15H2,1H3/t18-,19-,21?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity against human M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FLIPR				J Med Chem 52: 5241-52 (2010) Article DOI: 10.1021/jm900736e BindingDB Entry DOI: 10.7270/Q2PK0H54
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