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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM152508'   
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


(Homo sapiens (Human))
BDBM152508
PNG
((2-Bromo-4-hydroxyphenyl)(2,3-dihydroxyphenyl)meth...)
Show SMILES Oc1ccc(C(=O)c2cccc(O)c2O)c(Br)c1
Show InChI InChI=1S/C13H9BrO4/c14-10-6-7(15)4-5-8(10)12(17)9-2-1-3-11(16)13(9)18/h1-6,15-16,18H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.75n/a 4.84n/an/an/an/a8.0n/a



Ataturk University



Assay Description
AChI and 5,5'-dithio-bis(2-nitro-benzoic)acid (DTNB) were used as substrate for this enzymatic reaction. To this end, 100 ÁL of Tris/HCl buffer (...


Bioorg Chem 60: 49-57 (2015)


Article DOI: 10.1016/j.bioorg.2015.04.006
BindingDB Entry DOI: 10.7270/Q2930RW6
More data for this
Ligand-Target Pair