null

SMILES CCCOCCc1cc(-c2ccc(cc2)S(C)(=O)=O)n(c1C)-c1ccccc1

InChI Key InChIKey=VYMRHGYLWDUCCA-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50262990   

TargetProstaglandin G/H synthase 1(Homo sapiens (Human))
Universita di Siena

Curated by ChEMBL
LigandPNGBDBM50262990(CHEMBL517675 | [2-Methyl-5-(4-methylsulphonyl)phen...)copy SMILEScopy InChI
Affinity DataIC50: 8.60E+4nMAssay Description:Inhibition of COX1 in LPS-induced human whole blood assessed as PGE2 productionMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0N55PubMed
TargetProstaglandin G/H synthase 2(Mus musculus (Mouse))
Universita di Siena

Curated by ChEMBL
LigandPNGBDBM50262990(CHEMBL517675 | [2-Methyl-5-(4-methylsulphonyl)phen...)copy SMILEScopy InChI
Affinity DataIC50: 18nMAssay Description:Inhibition of mouse COX2 in LPS-stimulated mouse J774 cells assessed as PGE2 production by radioimmunoassayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0N55PubMed
TargetProstaglandin G/H synthase 1(Mus musculus)
Universita di Siena

Curated by ChEMBL
LigandPNGBDBM50262990(CHEMBL517675 | [2-Methyl-5-(4-methylsulphonyl)phen...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of mouse COX1 in mouse J774 cells assessed as PGE2 production by radioimmunoassayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0N55PubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
Universita di Siena

Curated by ChEMBL
LigandPNGBDBM50262990(CHEMBL517675 | [2-Methyl-5-(4-methylsulphonyl)phen...)copy SMILEScopy InChI
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of COX2 in human whole blood assessed as effect on thrombin-induced TXB2 productionMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0N55PubMed