BDBM50213553 (S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propanoic acid::CHEMBL236433

SMILES C[C@H](C(O)=O)c1ccc2OCCOc2c1

InChI Key InChIKey=REEHPTZXDPTHNZ-ZETCQYMHSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50213553   

TargetDehydrogenase/reductase SDR family member 9(Rattus norvegicus)
Universitat De Barcelona

Curated by ChEMBL
LigandPNGBDBM50213553((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of rat liver 3-alpha-HSD assessed as 5-beta-dihydrocortisone reductionMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 1(Homo sapiens (Human))
Universitat De Barcelona

Curated by ChEMBL
LigandPNGBDBM50213553((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...)
Affinity DataIC50:  1.30E+4nMAssay Description:Inhibition of COX1 in human whole blood after 15 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDehydrogenase/reductase SDR family member 9(Rattus norvegicus)
Universitat De Barcelona

Curated by ChEMBL
LigandPNGBDBM50213553((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...)
Affinity DataIC50:  3.00E+5nMAssay Description:Inhibition of rat liver 3-alpha-HSD assessed as 5-beta-dihydrocortisone reductionMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
Universitat De Barcelona

Curated by ChEMBL
LigandPNGBDBM50213553((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...)
Affinity DataIC50:  1.65E+4nMAssay Description:Inhibition of COX2 in human whole blood after 15 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed