Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50419507'   

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))	BDBM50419507 (CHEMBL1924046) Show SMILES CC(C)=CCC[N+]12CCC(CC1)[C@H](C2)OC(=O)[C@@](C)(N1CCCCC1)c1ccccc1 |r,wU:17.19,wD:17.18,12.15,(3.92,-13.41,;2.61,-14.22,;2.65,-15.76,;1.25,-13.49,;-.05,-14.3,;-1.41,-13.57,;-1.45,-12.03,;-.12,-11.27,;-.12,-9.73,;-1.45,-8.94,;-2.24,-10.27,;-.75,-10.67,;-2.79,-9.73,;-2.79,-11.27,;-4.13,-8.95,;-5.47,-9.73,;-5.46,-11.28,;-6.81,-8.96,;-6.82,-10.5,;-6.82,-7.42,;-5.48,-6.64,;-5.48,-5.1,;-6.82,-4.33,;-8.16,-5.1,;-8.16,-6.65,;-8.15,-9.72,;-9.47,-8.93,;-10.81,-9.69,;-10.83,-11.23,;-9.49,-12.01,;-8.16,-11.25,)| Show InChI InChI=1S/C27H41N2O2/c1-22(2)11-10-18-29-19-14-23(15-20-29)25(21-29)31-26(30)27(3,24-12-6-4-7-13-24)28-16-8-5-9-17-28/h4,6-7,11-13,23,25H,5,8-10,14-21H2,1-3H3/q+1/t23?,25-,27-,29?/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	0.631	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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