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BDBM50342768 4-(3-(Dimethylamino)propylamino)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770209

SMILES: CN(C)CCCNc1ccc2C(=O)c3ccccc3-c3nccc1c23

InChI Key: InChIKey=ZBMIZTIAZBZING-UHFFFAOYSA-N

Data: 2 IC50

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 = 50342768   
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
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50342768
PNG
(4-(3-(Dimethylamino)propylamino)-7H-dibenzo[de,h]q...)
Show SMILES CN(C)CCCNc1ccc2C(=O)c3ccccc3-c3nccc1c23
Show InChI InChI=1S/C21H21N3O/c1-24(2)13-5-11-22-18-9-8-17-19-16(18)10-12-23-20(19)14-6-3-4-7-15(14)21(17)25/h3-4,6-10,12,22H,5,11,13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.35E+3n/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
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342768
PNG
(4-(3-(Dimethylamino)propylamino)-7H-dibenzo[de,h]q...)
Show SMILES CN(C)CCCNc1ccc2C(=O)c3ccccc3-c3nccc1c23
Show InChI InChI=1S/C21H21N3O/c1-24(2)13-5-11-22-18-9-8-17-19-16(18)10-12-23-20(19)14-6-3-4-7-15(14)21(17)25/h3-4,6-10,12,22H,5,11,13H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 398n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE 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