BDBM91427 2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-(2-phenylethyl)benzoic acid::2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-phenethyl-benzoic acid::4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-phenylethyl)benzoic acid::MLS002630965::SMR001544280::cid_17950432

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

InChI Key InChIKey=DHIHEAVFVQOPBX-UHFFFAOYSA-N

Data  1 KI  1 IC50  3 Kd  3 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 8 hits for monomerid = 91427   

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

Curated by PubChem BioAssay
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataEC50:  3.52E+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
TargetCorticotropin-releasing factor-binding protein(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataIC50: 1.21E+4nMMore 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
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataEC50:  458nMAssay Description:Activity at human PPARgamma transfected in HEK293 cells assessed as transactivation activity by luciferase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2016
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Universitat Rovira I Virgili (Urv)

Curated by ChEMBL
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataKd:  236nMAssay Description:Binding affinity to human PPARgamma (unknown origin) by competitive TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor delta(Human)
Helmholtz Centre For Infection Research

Curated by ChEMBL
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataKd:  2.70E+4nMAssay Description:Binding affinity to human PPARdelta (unknown origin) by competitive TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor alpha(Human)
Helmholtz Centre For Infection Research

Curated by ChEMBL
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataKd:  2.70E+4nMAssay Description:Binding affinity to human PPARalpha (unknown origin) by competitive TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Universitat Rovira I Virgili (Urv)

Curated by ChEMBL
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataEC50:  458nMAssay Description:Agonist at human PPARgamma LBD expressed in human HEK293 cells cotransfected with GAL4-Luc assessed as transcriptional activation by luciferase repor...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Universitat Rovira I Virgili (Urv)

Curated by ChEMBL
LigandPNGBDBM91427(4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-6-(2-p...)
Affinity DataKi:  236nMAssay Description:Binding affinity to PPARgamma (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed