Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50419492'   

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))	BDBM50419492 (CHEMBL1921926) Show SMILES C[C@@](N1CCCCC1)(C(=O)O[C@H]1C[N+]2(CCCc3ccc4ncsc4c3)CCC1CC2)c1ccccc1 |r,wU:1.0,wD:1.8,11.11,(11.38,-45.15,;11.39,-43.61,;11.38,-42.06,;12.72,-41.3,;12.72,-39.76,;11.38,-38.98,;10.04,-39.76,;10.04,-41.31,;12.73,-44.38,;12.73,-45.93,;14.06,-43.6,;15.4,-44.37,;15.4,-45.92,;16.74,-46.68,;16.78,-48.21,;18.14,-48.94,;19.45,-48.14,;20.8,-48.86,;20.8,-50.4,;22.13,-51.17,;23.46,-50.41,;24.92,-50.89,;25.84,-49.65,;24.94,-48.4,;23.47,-48.87,;22.13,-48.09,;18.07,-45.92,;18.07,-44.37,;16.74,-43.59,;15.96,-44.92,;17.44,-45.31,;10.06,-44.38,;8.73,-43.62,;7.4,-44.39,;7.41,-45.93,;8.75,-46.69,;10.07,-45.92,)| Show InChI InChI=1S/C31H40N3O2S/c1-31(26-10-4-2-5-11-26,33-16-6-3-7-17-33)30(35)36-28-22-34(19-14-25(28)15-20-34)18-8-9-24-12-13-27-29(21-24)37-23-32-27/h2,4-5,10-13,21,23,25,28H,3,6-9,14-20,22H2,1H3/q+1/t25?,28-,31-,34?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.398	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [3H]NMS from recombinant human M3 receptor expressed in CHO-K1 cells after 16 hrs				Bioorg Med Chem Lett 21: 7440-6 (2011) Article DOI: 10.1016/j.bmcl.2011.10.002 BindingDB Entry DOI: 10.7270/Q2H41SPH
					More data for this Ligand-Target Pair