BindingDB logo
myBDB logout

BDBM9422 CHEMBL126457::N-{2-[1-(cyclopropylmethyl)piperidin-4-yl]ethyl}-N-methylbenzamide hydrochloride::Piperidine Derivative 34

SMILES: CN(CCC1CCN(CC2CC2)CC1)C(=O)c1ccccc1

InChI Key: InChIKey=GFSATERCQIHYAN-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 = 9422   
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


(Mus musculus (mouse))
BDBM9422
PNG
(CHEMBL126457 | N-{2-[1-(cyclopropylmethyl)piperidi...)
Show SMILES CN(CCC1CCN(CC2CC2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C19H28N2O/c1-20(19(22)18-5-3-2-4-6-18)12-9-16-10-13-21(14-11-16)15-17-7-8-17/h2-6,16-17H,7-15H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9422
PNG
(CHEMBL126457 | N-{2-[1-(cyclopropylmethyl)piperidi...)
Show SMILES CN(CCC1CCN(CC2CC2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C19H28N2O/c1-20(19(22)18-5-3-2-4-6-18)12-9-16-10-13-21(14-11-16)15-17-7-8-17/h2-6,16-17H,7-15H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...


J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair