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BDBM50413414 CHEMBL492988

SMILES: O=C(NCc1cccc(c1)-c1cccc(CN2C[C@@H]3C[C@H]2CN3)c1)c1ccc2OCOc2c1

InChI Key: InChIKey=KENDXJSKWIECKF-ZEQRLZLVSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50413414   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50413414
PNG
(CHEMBL492988)
Show SMILES O=C(NCc1cccc(c1)-c1cccc(CN2C[C@@H]3C[C@H]2CN3)c1)c1ccc2OCOc2c1
Show InChI InChI=1S/C27H27N3O3/c31-27(22-7-8-25-26(11-22)33-17-32-25)29-13-18-3-1-5-20(9-18)21-6-2-4-19(10-21)15-30-16-23-12-24(30)14-28-23/h1-11,23-24,28H,12-17H2,(H,29,31)/t23-,24-/m0/s1
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PC sid
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Similars

Article
PubMed
n/an/a 79.4n/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