BDBM224305 3-(6-{[(1r)-1- cyclobutylethyl]amino}-7-{[trans- 3,3-difluoro-4- methylcyclohexyl]methyl}-8-[(3r)- 3-methylmorpholin-4-yl]-7h-purin- 2-yl)-1,2,4-oxadiazol-5(4h)-one (diastereoisomer 1)::US9540377, 18.31::US9540377, 18.32

SMILES CC1CCC(Cn2c(N3CCOC[C@H]3C)nc3nc(-c4noc(=O)[nH]4)nc(N[C@H](C)C4CCC4)c32)CC1(F)F

InChI Key InChIKey=JIHYBCSXGGVPIW-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 224305   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 224305BDBM224305(US9540377, 18.31 | 3-(6-{[(1r)-1- cyclobutylethyl]...)
Affinity DataIC50: 8.12nMT: 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

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

US Patent
LigandChemical structure of BindingDB Monomer ID 224305BDBM224305(US9540377, 18.31 | 3-(6-{[(1r)-1- cyclobutylethyl]...)
Affinity DataIC50: 11.2nMT: 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