BDBM50303448 Beta-elemonic acid::CHEMBL566929

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6@@H](-[#6@H]1-[#6]-[#6][C@]2([#6])[#6]-3=[#6](-[#6]-[#6][C@@]12[#6])[C@@]1([#6])[#6]-[#6]-[#6](=O)C([#6])([#6])[#6@H]1-[#6]-[#6]-3)-[#6](-[#8])=O

InChI Key InChIKey=XLPAINGDLCDYQV-DXXDIINSSA-N

Data  4 IC50  1 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 5 hits for monomerid = 50303448   

TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University Of Tuebingen

Curated by ChEMBL
LigandPNGBDBM50303448(Beta-elemonic acid | CHEMBL566929)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of ovine COX-1 using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition measured after 5 mins by HPLC an...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
University Of Tuebingen

Curated by ChEMBL
LigandPNGBDBM50303448(Beta-elemonic acid | CHEMBL566929)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of human recombinant COX-2 using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition measured after 5 min...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetG-protein coupled bile acid receptor 1(Homo sapiens (Human))
Universite Louis Pasteur

Curated by ChEMBL
LigandPNGBDBM50303448(Beta-elemonic acid | CHEMBL566929)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at TGR5 expressed in CHO cells by CRE-driven luciferase reporter gene assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProlyl endopeptidase(Homo sapiens (Human))
University Of Karachi

Curated by ChEMBL
LigandPNGBDBM50303448(Beta-elemonic acid | CHEMBL566929)
Affinity DataIC50:  3.97E+4nMAssay Description:Inhibition of prolyl endopeptidaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin E synthase(Homo sapiens (Human))
University Of Tuebingen

Curated by ChEMBL
LigandPNGBDBM50303448(Beta-elemonic acid | CHEMBL566929)
Affinity DataIC50:  900nMAssay Description:Inhibition of microsomal PGES1 isolated from IL-1beta-stimulated human A549 cells preincubated for 15 mins followed by substrate addition measured af...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed