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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50342760'   
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
Cholinesterase


(Equus caballus (Horse))
BDBM50342760
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCC1
Show InChI InChI=1S/C23H23N2O2/c1-25(11-4-5-12-25)13-14-27-20-15-24-22-16-7-2-3-8-17(16)23(26)19-10-6-9-18(20)21(19)22/h2-3,6-10,15H,4-5,11-14H2,1H3/q+1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 302n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE 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