null

SMILES CC(C)(C)c1cc(cc(c1O)C(C)(C)C)-c1nnc(NC#N)o1

InChI Key InChIKey=XHFSJZHATNKAKR-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 = 50075531   

TargetProstaglandin G/H synthase 1(Homo sapiens (Human))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50075531(5-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-[1,3,4]oxad...)copy SMILEScopy InChI
Affinity DataIC50: 5.80E+3nMAssay Description:IC50 value against Prostaglandin G/H synthase 1 of human platelet rich plasmaMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2154G6NPubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50075531(5-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-[1,3,4]oxad...)copy SMILEScopy InChI
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of recombinant human prostaglandin G/H synthase 2 (COX-2)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2154G6NPubMed
TargetProstaglandin G/H synthase 2(Mus musculus (Mouse))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50075531(5-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-[1,3,4]oxad...)copy SMILEScopy InChI
Affinity DataIC50: 390nMAssay Description:IC50 value against Prostaglandin G/H synthase 2 of murine J774A.1 cell lineMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2154G6NPubMed
TargetProstaglandin G/H synthase 1(Homo sapiens (Human))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50075531(5-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-[1,3,4]oxad...)copy SMILEScopy InChI
Affinity DataIC50: 390nMAssay Description:IC50 value against ovine Prostaglandin G/H synthase 1More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2154G6NPubMed