Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50571307'   

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))	BDBM50571307 (CHEMBL566204) Show SMILES O=C(OC1CN2CCC1CC2)N1CCc2ccccc2[C@@H]1c1ccccc1 |r,wD:20.24,THB:2:3:9.10:7.6,(23.17,-9.1,;23.17,-7.56,;21.83,-6.79,;20.48,-7.56,;20.58,-9.1,;19.2,-8.21,;17.47,-8.66,;17.48,-7.17,;19.15,-6.7,;19.48,-4.97,;19.78,-6.21,;24.49,-6.77,;24.47,-5.23,;25.82,-4.46,;27.15,-5.25,;28.48,-4.49,;29.79,-5.25,;29.79,-6.77,;28.46,-7.54,;27.15,-6.77,;25.83,-7.54,;25.83,-9.1,;24.5,-9.87,;24.52,-11.4,;25.86,-12.17,;27.18,-11.37,;27.18,-9.85,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	733	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at muscarinic M3 receptor (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2021.128209 BindingDB Entry DOI: 10.7270/Q2BG2SRP
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