BDBM221459 6-{[(1r)-1-cyclobutyl- 4-(4-methylpiperazin- l-yl)butyl]amino}-8- (3-methylphenyl)-7- [4- (trifluoromethyl)benzyl]- 7h-purine-2- carboxylic acid::US9540377, 7.10

SMILES CN1CCN(CCC[C@@H](Nc2nc(nc3nc(-c4cccc(C)c4)n(Cc4ccc(cc4)C(F)(F)F)c23)C(O)=O)C2CCC2)CC1

InChI Key InChIKey=SAWDZWCUKLYYBL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 221459   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 221459BDBM221459(US9540377, 7.10 | 6-{[(1r)-1-cyclobutyl- 4-(4-meth...)
Affinity DataIC50: 94.3nMT: 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