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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50342761'   
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
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50342761
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCCC1
Show InChI InChI=1S/C24H25N2O2/c1-26(12-5-2-6-13-26)14-15-28-21-16-25-23-17-8-3-4-9-18(17)24(27)20-11-7-10-19(21)22(20)23/h3-4,7-11,16H,2,5-6,12-15H2,1H3/q+1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 95n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method

Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair