Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50419470'   

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))	BDBM50419470 (CHEMBL1922056) Show SMILES C[C@@](N1CCCCC1)(C(=O)O[C@H]1C[N+]2(Cc3nc(no3)-c3ccccc3)CCC1CC2)c1ccccc1 |r,wU:1.0,wD:1.8,11.11,(-5.9,-46.24,;-5.89,-44.7,;-5.9,-43.15,;-4.56,-42.38,;-4.56,-40.85,;-5.9,-40.07,;-7.24,-40.84,;-7.24,-42.4,;-4.55,-45.47,;-4.55,-47.02,;-3.21,-44.69,;-1.87,-45.46,;-1.87,-47.01,;-.54,-47.77,;-.53,-49.31,;.81,-50.07,;2.28,-49.59,;3.18,-50.83,;2.28,-52.07,;.82,-51.6,;4.72,-50.82,;5.49,-52.16,;7.03,-52.16,;7.8,-50.82,;7.02,-49.49,;5.48,-49.5,;.8,-47.01,;.8,-45.46,;-.54,-44.68,;-1.32,-46.01,;.16,-46.4,;-7.23,-45.47,;-8.55,-44.69,;-9.88,-45.46,;-9.89,-47,;-8.54,-47.77,;-7.22,-47,)| Show InChI InChI=1S/C30H37N4O3/c1-30(25-13-7-3-8-14-25,33-17-9-4-10-18-33)29(35)36-26-21-34(19-15-23(26)16-20-34)22-27-31-28(32-37-27)24-11-5-2-6-12-24/h2-3,5-8,11-14,23,26H,4,9-10,15-22H2,1H3/q+1/t23?,26-,30-,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	0.316	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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