BDBM89212 3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-2-hydroxy-4-methoxy-6-(2-phenylethyl)benzoic acid::3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-2-hydroxy-4-methoxy-6-phenethyl-benzoic acid::3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methoxy-2-oxidanyl-6-(2-phenylethyl)benzoic acid::MLS002630966::SMR001544281::cid_44601732

SMILES [#6]-[#8]-c1cc(-[#6]-[#6]-c2ccccc2)c(-[#6](-[#8])=O)c(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6]

InChI Key InChIKey=AOFZKACZCBVRHL-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 89212   

TargetCorticotropin-releasing factor-binding protein(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM89212(3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methoxy-2-o...)
Affinity DataEC50: >5.30E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay
TargetDNA (cytosine-5)-methyltransferase 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM89212(3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methoxy-2-o...)
Affinity DataIC50: 3.50E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay
TargetCorticotropin-releasing factor-binding protein(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM89212(3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methoxy-2-o...)
Affinity DataIC50: 3.79E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetPeroxisome proliferator-activated receptor gamma(Human)
Universitat Rovira I Virgili (Urv)

Curated by ChEMBL
LigandPNGBDBM89212(3-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methoxy-2-o...)
Affinity DataEC50:  73nMAssay Description:Activity at PPARgamma (unknown origin) assessed as transactivation activity by reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2016
Entry Details Article
PubMed