BDBM661995 N-(4-((E)-2-(2-(((1r,4r)-4- aminocyclohexyl)amino)pyrimidin-5- yl)vinyl)-2-fluorophenyl)-2- chlorobenzenesulfonamide::US11945784, Compound 3

SMILES NC1CCC(Nc2ncc(/C=C/c3ccc(NS(=O)(=O)c4ccccc4Cl)c(F)c3)cn2)CC1

InChI Key InChIKey=UENNUGQFGRSIHE-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 661995   

TargetSerine/threonine-protein kinase/endoribonuclease IRE1(Human)
Cornell University

US Patent
LigandChemical structure of BindingDB Monomer ID 661995BDBM661995(N-(4-((E)-2-(2-(((1r,4r)-4- aminocyclohexyl)amino)...)
Affinity DataIC50: 1nMAssay Description:In vitro FRET assay was performed to evaluate the ability of select compounds to inhibit IRE1, the results of which are summarized in Table 3. To per...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/17/2024
Entry Details
US Patent