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BDBM50429796 CHEMBL2337265

SMILES: Oc1ccc(-c2nnc(s2)-c2ccc(O)c(O)c2)c(O)c1

InChI Key: InChIKey=WCWJMCVRJVZEQB-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50429796   
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


(Electrophorus electricus (Electric eel))
BDBM50429796
PNG
(CHEMBL2337265)
Show SMILES Oc1ccc(-c2nnc(s2)-c2ccc(O)c(O)c2)c(O)c1
Show InChI InChI=1S/C14H10N2O4S/c17-8-2-3-9(11(19)6-8)14-16-15-13(21-14)7-1-4-10(18)12(20)5-7/h1-6,17-20H
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 190n/an/an/an/an/an/a



University of Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylcholine iodide as substrate after 10 mins by Ellman method


Eur J Med Chem 62: 311-9 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.060
BindingDB Entry DOI: 10.7270/Q27S7Q4V
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50429796
PNG
(CHEMBL2337265)
Show SMILES Oc1ccc(-c2nnc(s2)-c2ccc(O)c(O)c2)c(O)c1
Show InChI InChI=1S/C14H10N2O4S/c17-8-2-3-9(11(19)6-8)14-16-15-13(21-14)7-1-4-10(18)12(20)5-7/h1-6,17-20H
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.16E+3n/an/an/an/an/an/a



University of Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE using butylthiocholine iodide as substrate after 10 mins by Ellman method


Eur J Med Chem 62: 311-9 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.060
BindingDB Entry DOI: 10.7270/Q27S7Q4V
More data for this
Ligand-Target Pair