Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50345691'   

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))	BDBM50345691 ((3-endo)-3-[2-Hydroxy-2,2-bis(2-methylphenyl)ethyl...) Show SMILES Cc1ccccc1C(O)(CC1C[C@H]2CCC[C@H](C1)[N+]2(C)C)c1ccccc1C |r,TLB:9:10:18:13.15.14| Show InChI InChI=1S/C26H36NO/c1-19-10-5-7-14-24(19)26(28,25-15-8-6-11-20(25)2)18-21-16-22-12-9-13-23(17-21)27(22,3)4/h5-8,10-11,14-15,21-23,28H,9,12-13,16-18H2,1-4H3/q+1/t22-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	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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