BDBM111370 US8614253, 32-6::US9241942, 32-6::US9493435, 180

SMILES CC(C)NC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1

InChI Key InChIKey=UCAXXLONPOURJE-UHFFFAOYSA-N

Data  3 IC50  1 EC50

  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 = 111370   

LigandPNGBDBM111370(US8614253, 32-6 | US9493435, 180 | US9241942, 32-6)
Affinity DataIC50: 47nMpH: 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
US Patent

LigandPNGBDBM111370(US8614253, 32-6 | US9493435, 180 | US9241942, 32-6)
Affinity DataIC50: 47nMpH: 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
US Patent

LigandPNGBDBM111370(US8614253, 32-6 | US9493435, 180 | US9241942, 32-6)
Affinity DataEC50:  5.00E+4nMAssay 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
US Patent

LigandPNGBDBM111370(US8614253, 32-6 | US9493435, 180 | US9241942, 32-6)
Affinity DataIC50: 100nMpH: 7.5 T: 2°CAssay Description:A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...More data for this Ligand-Target Pair
In DepthDetails
US Patent