BDBM222704 6-{[(1r)-1- cyclobutylethyl](prop-2-en- 1-yl)amino}-8-[(1-pyridin- 2-ylethyl)amino]-7[4- (trifluoromethyl)benzyl]- 7h-purine-2-carboxylic acid::US9540377, 10.31

SMILES CC(Nc1nc2nc(nc(N(CC=C)[C@H](C)C3CCC3)c2n1Cc1ccc(cc1)C(F)(F)F)C(O)=O)c1ccccn1

InChI Key InChIKey=HVDPLBZWKVZRPX-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 = 222704   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 222704BDBM222704(US9540377, 10.31 | 6-{[(1r)-1- cyclobutylethyl](pr...)
Affinity DataIC50: 54.9nMT: 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