BDBM535739 (3R)-6-[1-(1-acetylpiperidin-4-yl)-1- hydroxyethyl]-3-(4-chlorophenyl)-2- [(5-chloropyrimidin-2-yl)methyl]-4- fluoro-3-[cis-3-hydroxycyclobutoxy]- 2,3-dihydro-1H-isoindol-1-one Ex. 425 is the slower eluting isomer::US11236047, Example 425

SMILES CC(=O)N1CCC(C(C)(O)c2cc(F)c3c(c2)C(=O)N(Cc2ncc(Cl)cn2)[C@@]3(O[C@H]2C[C@@H](O)C2)c2ccc(Cl)cc2)CC1

InChI Key InChIKey=NQWJDULBVXLQNH-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 = 535739   

TargetE3 ubiquitin-protein ligase Mdm2(Human)
Astex Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 535739BDBM535739((3R)-6-[1-(1-acetylpiperidin-4-yl)-1- hydroxyethyl...)
Affinity DataIC50: 1.90nMAssay Description:The ELISA assay was performed in streptavidin coated plates which were preincubated with 200 ul per well of 1 μg ml−1 biotinylated IP3 pep...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/6/2022
Entry Details
US Patent