BDBM213845 6-{[(1r)-1- cyclobutylethyl]amino}- 8-[3-methyl-4-(1- methylethyl)pyridin-2- yl]-7-[4- (trifluoromethyl)benzyl]- 7h-purine-2-carboxylic acid::US9540377, 1.87

SMILES CC(C)c1ccnc(-c2nc3nc(nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(cc2)C(F)(F)F)C(O)=O)c1C

InChI Key InChIKey=NFPWPVBREXKEHT-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 213845   

TargetE3 ubiquitin-protein ligase Mdm2 [17-125](Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 213845BDBM213845(US9540377, 1.87 | 6-{[(1r)-1- cyclobutylethyl]amin...)
Affinity DataIC50: 59.0nMT: 2°CAssay Description:An HDM2 FRET assay was developed to assess the compounds' inhibitory activity towards binding of p53 protein. A truncated version of HDM2 with re...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/26/2018
Entry Details
US Patent