BDBM50174225 ((2E,6E)-3,7,11-Trimethyl-dodeca-2,6,10-trienylsulfanyl)-acetic acid anion

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#16]-[#6]-[#6](-[#8-])=O

InChI Key InChIKey=MLDQXACKTQIWSI-UHFFFAOYSA-M

Data  1 KI  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50174225   

LigandPNGBDBM50174225(((2E,6E)-3,7,11-Trimethyl-dodeca-2,6,10-trienylsul...)
Affinity DataEC50:  9.00E+4nMAssay Description:Agonist activity at human TRPA1 channel expressed in CHO cells assessed as increase in intracellular calcium levelsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetProtein-S-isoprenylcysteine O-methyltransferase(Baker's yeast)
Purdue University

Curated by ChEMBL
LigandPNGBDBM50174225(((2E,6E)-3,7,11-Trimethyl-dodeca-2,6,10-trienylsul...)
Affinity DataKi:  4.60E+3nMAssay Description:Inhibitory concentration against isoprenyl-cysteine carboxyl methyltransferaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed