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BDBM50335637 CHEMBL1651810::N-[2-({2-[(2-Aminoethyl)amino]ethyl}amino)ethyl]-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide

SMILES: NCCNCCNCCNC(=O)c1c(O)c2ccccc2[nH]c1=O

InChI Key: InChIKey=FCPJAACLGKPDJK-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50335637   
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))
BDBM50335637
PNG
(CHEMBL1651810 | N-[2-({2-[(2-Aminoethyl)amino]ethy...)
Show SMILES NCCNCCNCCNC(=O)c1c(O)c2ccccc2[nH]c1=O
Show InChI InChI=1S/C16H23N5O3/c17-5-6-18-7-8-19-9-10-20-15(23)13-14(22)11-3-1-2-4-12(11)21-16(13)24/h1-4,18-19H,5-10,17H2,(H,20,23)(H2,21,22,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Université de Franche-Comté

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE after 15 mins by Ellman's method


Eur J Med Chem 46: 1-10 (2010)


Article DOI: 10.1016/j.ejmech.2010.08.054
BindingDB Entry DOI: 10.7270/Q2NZ87X6
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50335637
PNG
(CHEMBL1651810 | N-[2-({2-[(2-Aminoethyl)amino]ethy...)
Show SMILES NCCNCCNCCNC(=O)c1c(O)c2ccccc2[nH]c1=O
Show InChI InChI=1S/C16H23N5O3/c17-5-6-18-7-8-19-9-10-20-15(23)13-14(22)11-3-1-2-4-12(11)21-16(13)24/h1-4,18-19H,5-10,17H2,(H,20,23)(H2,21,22,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.90E+4n/an/an/an/an/an/a



Université de Franche-Comté

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE after 15 mins by Ellman's method


Eur J Med Chem 46: 1-10 (2010)


Article DOI: 10.1016/j.ejmech.2010.08.054
BindingDB Entry DOI: 10.7270/Q2NZ87X6
More data for this
Ligand-Target Pair