Compile Data Set for Download or QSAR
maximum 50k data

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 8 hits in this display   

TargetSerine protease hepsin(Homo sapiens (Human))
Fred Hutchinson Cancer Research Center

US Patent
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50:  430nMAssay Description:To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetNAD-dependent protein deacylase sirtuin-5, mitochondrial(Homo sapiens (Human))
Ludwig-Maximilians University

Curated by ChEMBL
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50:  1.60E+3nMAssay Description:Inhibition of SIRT5 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Homo sapiens (Human))
Atherogenics

Curated by ChEMBL
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50:  1.40E+4nMAssay Description:Inhibition of 15-lipoxygenase by LMB assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Bos taurus (Bovine))
Fred Hutchinson Cancer Research Center

US Patent
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50: >2.00E+4nMAssay Description:To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetTrypsin(Sus scrofa)
Fred Hutchinson Cancer Research Center

US Patent
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50:  3.35E+4nMAssay Description:To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetCytochrome P450 2J2(Homo sapiens (Human))
Tongji University

Curated by ChEMBL
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of human recombinant CYP2J2 assessed as reduction in astemizole O-demethylation by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVascular cell adhesion protein 1(Homo sapiens (Human))
Atherogenics

Curated by ChEMBL
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of TNF-alpha inducible Vascular cell adhesion molecule-1 expression.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBile salt export pump(Homo sapiens (Human))
Astrazeneca

Curated by ChEMBL
LigandPNGBDBM50007260(2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydrox...)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed