Compile Data Set for Download or QSAR
Found 3 Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase/endoribonuclease IRE1' and Ligand = 'BDBM111368'
TargetSerine/threonine-protein kinase/endoribonuclease IRE1(Homo sapiens (Human))
MannKind Corporation

US Patent
LigandPNGBDBM111368(US8614253, 32-4 | US9241942, 32-4 | US9493435, 168)copy SMILEScopy InChI
Affinity DataIC50: 3nMpH: 7.5 T: 2°CAssay Description:IRE-1 alpha, T1 RNase, and RNase A assays carried out in vitro with several o-vanillin derivatives to demonstrate selectivity of the derivatives for ...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2RF5SQRUS Patent
TargetSerine/threonine-protein kinase/endoribonuclease IRE1(Homo sapiens (Human))
MannKind Corporation

US Patent
LigandPNGBDBM111368(US8614253, 32-4 | US9241942, 32-4 | US9493435, 168)copy SMILEScopy InChI
Affinity DataIC50: 3nMpH: 7.5Assay Description:A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) was obtained from a 500 ml baculovirus-infected i...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q25B0192US Patent
TargetSerine/threonine-protein kinase/endoribonuclease IRE1(Homo sapiens (Human))
MannKind Corporation

US Patent
LigandPNGBDBM111368(US8614253, 32-4 | US9241942, 32-4 | US9493435, 168)copy SMILEScopy InChI
Affinity DataEC50:  5.00E+3nMAssay Description:Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q25B0192US Patent