BDBM222701 6-{[(1r)-1- cyclobutylethyl](prop-2-en- 1-yl)amino}-8-{[(1s)-1-(3- fluorophenyl)ethyl]amino}- 7-[4- (trifluoromethyl)benzyl]- 7h-purine-2-carboxylic acid::US9540377, 10.28

SMILES C[C@H](Nc1nc2nc(nc(N(CC=C)[C@H](C)C3CCC3)c2n1Cc1ccc(cc1)C(F)(F)F)C(O)=O)c1cccc(F)c1

InChI Key InChIKey=GUVPZORGCUFSDC-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 = 222701   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 222701BDBM222701(US9540377, 10.28 | 6-{[(1r)-1- cyclobutylethyl](pr...)
Affinity DataIC50: 22.2nMT: 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