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SMILES: [Cl-].Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1Cl

InChI Key: InChIKey=PLAYAOBOEZLPGS-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50052222   
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
Cholinesterase


(Equus caballus (Horse))
BDBM50052222
PNG
(CHEMBL3318408)
Show SMILES [Cl-].Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1Cl
Show InChI InChI=1S/C21H14Cl2N2O.ClH/c22-18-6-5-15(12-19(18)23)13-25-9-7-14(8-10-25)11-17-16-3-1-2-4-20(16)24-21(17)26;/h1-12H,13H2;1H
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



Yazd University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide substrate by Ellman method based spectrophotometry


Eur J Med Chem 84: 375-81 (2014)


Article DOI: 10.1016/j.ejmech.2014.01.017
BindingDB Entry DOI: 10.7270/Q2H996T1
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50052222
PNG
(CHEMBL3318408)
Show SMILES [Cl-].Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1Cl
Show InChI InChI=1S/C21H14Cl2N2O.ClH/c22-18-6-5-15(12-19(18)23)13-25-9-7-14(8-10-25)11-17-16-3-1-2-4-20(16)24-21(17)26;/h1-12H,13H2;1H
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 29n/an/an/an/an/an/a



Yazd University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide substrate by Ellman method based spectrophotometry


Eur J Med Chem 84: 375-81 (2014)


Article DOI: 10.1016/j.ejmech.2014.01.017
BindingDB Entry DOI: 10.7270/Q2H996T1
More data for this
Ligand-Target Pair