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BDBM50242975 CHEMBL4069096

SMILES: CCc1ccc(cc1)N1C(=O)C2CN(C)C3(C2C1=O)C(=O)c1ccccc1C3=O

InChI Key: InChIKey=BMWMIFFFCMWDDW-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50242975   
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
Cholinesterases


(Homo sapiens (Human))
BDBM50242975
PNG
(CHEMBL4069096)
Show SMILES CCc1ccc(cc1)N1C(=O)C2CN(C)C3(C2C1=O)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C23H20N2O4/c1-3-13-8-10-14(11-9-13)25-21(28)17-12-24(2)23(18(17)22(25)29)19(26)15-6-4-5-7-16(15)20(23)27/h4-11,17-18H,3,12H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Madurai Kamaraj University

Curated by ChEMBL


Assay Description
Inhibition of AChE (unknown origin) using acetylcholine as substrate preincubated for 15 mins followed by substrate addition measured every minute by...


Bioorg Med Chem Lett 27: 3071-3075 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.050
BindingDB Entry DOI: 10.7270/Q2BG2RDS
More data for this
Ligand-Target Pair