BDBM50272862 (E)-2'-des-methyl sulindac sulfide::2-desmethylsulindac sulfide::CHEMBL496464

SMILES CSc1ccc(\C=C2/C=C(CC(O)=O)c3cc(F)ccc23)cc1

InChI Key InChIKey=NEQPIGQSLNSVDO-MDWZMJQESA-N

Data  4 IC50  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 5 hits for monomerid = 50272862   

TargetPeroxisome proliferator-activated receptor gamma(Human)
Vanderbilt University Center For Structural Biology

Curated by ChEMBL
LigandPNGBDBM50272862((E)-2'-des-methyl sulindac sulfide | 2-desmethylsu...)
Affinity DataEC50:  700nMAssay Description:Agonist activity at PPARgamma expressed in human HCA7 cells assessed as induction of peroxisome proliferator response element after 12 hrs by lucifer...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProstaglandin G/H synthase 1(Human)
Vanderbilt Institute of Chemical Biology

Curated by ChEMBL
LigandPNGBDBM50272862((E)-2'-des-methyl sulindac sulfide | 2-desmethylsu...)
Affinity DataIC50:  1.80E+3nMAssay Description:Inhibition of ovine COX-1 using [14C] arachidonic acid as substrate preincubated for 17 mins before substrate addition measured after 3 mins by thin-...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProstaglandin G/H synthase 2(Human)
Vanderbilt Institute of Chemical Biology

Curated by ChEMBL
LigandPNGBDBM50272862((E)-2'-des-methyl sulindac sulfide | 2-desmethylsu...)
Affinity DataIC50: >4.00E+3nMAssay Description:Inhibition of COX2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProstaglandin G/H synthase 1(Human)
Vanderbilt Institute of Chemical Biology

Curated by ChEMBL
LigandPNGBDBM50272862((E)-2'-des-methyl sulindac sulfide | 2-desmethylsu...)
Affinity DataIC50:  1.80E+3nMAssay Description:Inhibition of COX1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProstaglandin G/H synthase 1(Human)
Vanderbilt Institute of Chemical Biology

Curated by ChEMBL
LigandPNGBDBM50272862((E)-2'-des-methyl sulindac sulfide | 2-desmethylsu...)
Affinity DataIC50:  116nMAssay Description:Inhibition of COX-1 in human OVCAR3 cells using [14C] arachidonic acid as substrate preincubated for 30 mins before substrate addition measured after...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed