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BDBM50321264 2-(4-allyl-2-methoxy-5-nitrophenoxy)acetic acid::CHEMBL1163999

SMILES: COc1cc(CC=C)c(cc1OCC(O)=O)[N+]([O-])=O

InChI Key: InChIKey=SZFIMRRKPKYNBF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50321264   
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
3-hydroxy-3-methylglutaryl-coenzyme A reductase


(Schizosaccharomyces pombe)
BDBM50321264
PNG
(2-(4-allyl-2-methoxy-5-nitrophenoxy)acetic acid | ...)
Show SMILES COc1cc(CC=C)c(cc1OCC(O)=O)[N+]([O-])=O
Show InChI InChI=1S/C12H13NO6/c1-3-4-8-5-10(18-2)11(19-7-12(14)15)6-9(8)13(16)17/h3,5-6H,1,4,7H2,2H3,(H,14,15)
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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.44E+5n/an/an/an/an/an/a



Instituto Polit£cnico Nacional (IPN)

Curated by ChEMBL


Assay Description
Inhibition of Schizosaccharomyces pombe HMG-CoA reductase by spectrophotometry


Bioorg Med Chem 18: 4238-48 (2010)


Article DOI: 10.1016/j.bmc.2010.04.096
BindingDB Entry DOI: 10.7270/Q2KW5H0Z
More data for this
Ligand-Target Pair