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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M3' and Ligand = 'BDBM50129251'   
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 M3


(Homo sapiens (Human))
BDBM50129251
PNG
(CHEMBL3627739)
Show SMILES COc1ccc(CCC(=O)NCC2(CCN(C)CC2)c2ccccc2)cc1
Show InChI InChI=1S/C23H30N2O2/c1-25-16-14-23(15-17-25,20-6-4-3-5-7-20)18-24-22(26)13-10-19-8-11-21(27-2)12-9-19/h3-9,11-12H,10,13-18H2,1-2H3,(H,24,26)
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Article
PubMed
1.54E+3n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Displacement of [3H]NMS from human muscarinic M3 receptor expressed in CHO cells after 2 hrs by liquid scintillation spectrometry analysis


Bioorg Med Chem Lett 25: 5032-5 (2015)


Article DOI: 10.1016/j.bmcl.2015.10.029
BindingDB Entry DOI: 10.7270/Q2S75J4G
More data for this
Ligand-Target Pair