BindingDB logo
myBDB logout

BDBM50308519 (E)-Dimethyl 1-(2-oxodihydrofuran-3(2H)-ylidene)ethylphosphate::CHEMBL591470

SMILES: COP(=O)(OC)O\C(C)=C1/CCOC1=O

InChI Key: InChIKey=XUMVWMVTRVLHEJ-VOTSOKGWSA-N

Data: 1 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 1 hit for monomerid = 50308519   
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))
BDBM50308519
PNG
((E)-Dimethyl 1-(2-oxodihydrofuran-3(2H)-ylidene)et...)
Show SMILES COP(=O)(OC)O\C(C)=C1/CCOC1=O
Show InChI InChI=1S/C8H13O6P/c1-6(7-4-5-13-8(7)9)14-15(10,11-2)12-3/h4-5H2,1-3H3/b7-6+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of human AChE by modified Ellman's spectrophotometric method


Bioorg Med Chem 18: 2265-74 (2010)


Article DOI: 10.1016/j.bmc.2010.01.063
BindingDB Entry DOI: 10.7270/Q2RV0NTP
More data for this
Ligand-Target Pair