Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50419488'   

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))	BDBM50419488 (CHEMBL1921932) Show SMILES Cc1ccc(OCC[N+]23CCC(CC2)[C@H](C3)OC(=O)[C@@](C)(N2CCCCC2)c2ccccc2)cc1 |r,wU:19.21,wD:19.20,14.17,(6.31,-15.61,;4.95,-14.89,;3.64,-15.7,;2.29,-14.98,;2.24,-13.45,;.89,-12.73,;-.42,-13.54,;-1.77,-12.81,;-1.82,-11.27,;-.48,-10.51,;-.48,-8.96,;-1.82,-8.18,;-2.6,-9.51,;-1.12,-9.9,;-3.15,-8.96,;-3.15,-10.51,;-4.5,-8.19,;-5.83,-8.97,;-5.83,-10.52,;-7.17,-8.2,;-7.19,-9.74,;-7.18,-6.65,;-5.84,-5.89,;-5.84,-4.35,;-7.18,-3.57,;-8.52,-4.35,;-8.52,-5.9,;-8.51,-8.96,;-9.84,-8.17,;-11.18,-8.93,;-11.2,-10.47,;-9.86,-11.25,;-8.52,-10.49,;3.54,-12.64,;4.89,-13.35,)| Show InChI InChI=1S/C30H41N2O3/c1-24-11-13-27(14-12-24)34-22-21-32-19-15-25(16-20-32)28(23-32)35-29(33)30(2,26-9-5-3-6-10-26)31-17-7-4-8-18-31/h3,5-6,9-14,25,28H,4,7-8,15-23H2,1-2H3/q+1/t25?,28-,30-,32?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.316	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
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