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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1' and Ligand = 'BDBM50111630'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50111630
PNG
(6-[4-(4-Benzyl-piperidin-1-yl)-butyl]-3-methyl-3H-...)
Show SMILES Cn1c2ccc(CCCCN3CCC(Cc4ccccc4)CC3)cc2sc1=O
Show InChI InChI=1S/C24H30N2OS/c1-25-22-11-10-20(18-23(22)28-24(25)27)9-5-6-14-26-15-12-21(13-16-26)17-19-7-3-2-4-8-19/h2-4,7-8,10-11,18,21H,5-6,9,12-17H2,1H3
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 200n/an/an/an/an/an/an/an/a



Université de Lille 2

Curated by ChEMBL


Assay Description
Compound was evaluated in vitro for its binding affinity towards Muscarinic acetylcholine receptor M1 by displacing [3H]- pyrilamine from rat brain m...

Bioorg Med Chem Lett 12: 1149-52 (2002)


BindingDB Entry DOI: 10.7270/Q2G44PM6
More data for this
Ligand-Target Pair