BDBM218830 6-{[(1r)-1- cyclobutylethyl]aminol -7- [3-fluoro-4- (trifluoromethoxy)benzyl]- 8-(3-methylphenyl)-7h- purine-2-carboxylic acid::US9540377, 5.14

SMILES C[C@@H](Nc1nc(nc2nc(-c3cccc(C)c3)n(Cc3ccc(OC(F)(F)F)c(F)c3)c12)C(O)=O)C1CCC1

InChI Key InChIKey=AEFOSCMRSIJAHS-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 = 218830   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 218830BDBM218830(US9540377, 5.14 | 6-{[(1r)-1- cyclobutylethyl]amin...)
Affinity DataIC50: 36.4nMT: 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