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BDBM50029915 2-(1-Benzyl-piperidin-4-ylmethyl)-5,6,7-trimethoxy-indan-1-one; hydrochloride::CHEMBL552871

SMILES: COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2c(OC)c1OC

InChI Key: InChIKey=OFXAQILQKJVEHQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50029915   
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
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50029915
PNG
(2-(1-Benzyl-piperidin-4-ylmethyl)-5,6,7-trimethoxy...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2c(OC)c1OC
Show InChI InChI=1S/C25H31NO4/c1-28-21-15-19-14-20(23(27)22(19)25(30-3)24(21)29-2)13-17-9-11-26(12-10-17)16-18-7-5-4-6-8-18/h4-8,15,17,20H,9-14,16H2,1-3H3
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Eisai Company, Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against acetylcholinesterase


J Med Chem 38: 4821-9 (1996)


Article DOI: 10.1021/jm00024a009
BindingDB Entry DOI: 10.7270/Q2QC045T
More data for this
Ligand-Target Pair