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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 = 'BDBM50413436'   
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))
BDBM50413436
PNG
(CHEMBL495360)
Show SMILES COc1ccc(cc1)C(=O)NCc1cccc(c1)-c1cccc(CN2CCNCC2)c1
Show InChI InChI=1S/C26H29N3O2/c1-31-25-10-8-22(9-11-25)26(30)28-18-20-4-2-6-23(16-20)24-7-3-5-21(17-24)19-29-14-12-27-13-15-29/h2-11,16-17,27H,12-15,18-19H2,1H3,(H,28,30)
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Article
PubMed
n/an/a 501n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobili...


Bioorg Med Chem Lett 19: 1686-90 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.098
BindingDB Entry DOI: 10.7270/Q2639QZ5
More data for this
Ligand-Target Pair