Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50129247'   

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))	BDBM50129247 (CHEMBL3629532) Show SMILES COc1ccc(CCNC(=O)C2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C22H28N2O2/c1-24-16-13-22(14-17-24,19-6-4-3-5-7-19)21(25)23-15-12-18-8-10-20(26-2)11-9-18/h3-11H,12-17H2,1-2H3,(H,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human muscarinic M3 receptor expressed in CHO cells after 2 hrs by liquid scintillation spectrometry analysis				Bioorg Med Chem Lett 25: 5032-5 (2015) Article DOI: 10.1016/j.bmcl.2015.10.029 BindingDB Entry DOI: 10.7270/Q2S75J4G
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