BDBM693421 N-(4-((3-(2-((5-(1,1- difluoroethyl)piperidin-3- yl)amino)pyrimidin-4-yl)pyridin-2- yl)oxy)-2,3,6-trifluorophenyl)-1- phenylmethanesulfonamide::US12071425, Compound 339

SMILES C[C@@](F)(F)C5CNC[C@H](Nc4nccc(c1cccnc1Oc3cc(F)c(NS(=O)(=O)Cc2ccccc2)c(F)c3F)n4)C5

InChI Key InChIKey=JULCXOGYAAOMKJ-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 693421   

LigandChemical structure of BindingDB Monomer ID 693421BDBM693421(N-(4-((3-(2-((5-(1,1- difluoroethyl)piperidin-3- y...)
Affinity DataIC50: 0.240nMAssay Description:To determine the affinity of compound binding to the kinase domain of IRE1 alpha, a Time Resolved Fluorescence Resonance Energy Transfer (TR-FRET) co...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2024
Entry Details
US Patent