BDBM448737 (S)-3-(2-(((S)-1-(4-((4- acryloylpiperazin-1- yl)methyl)phenyl)ethyl) amino)-5-fluoropyrimidin- 4-yl)-4-isopropyloxazolidin- 2-one::US10696665, Example 5

SMILES CC(C)[C@H]1COC(=O)N1c1nc(N[C@@H](C)c2ccc(CN3CCN(CC3)C(=O)C=C)cc2)ncc1F

InChI Key InChIKey=XUDLQQNNDGGTAI-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 448737   

LigandPNGBDBM448737((S)-3-(2-(((S)-1-(4-((4- acryloylpiperazin-1- yl)m...)
Affinity DataIC50: 35.3nMAssay Description:IDH1 mutant (R132H and R132C) and IDH2 mutant (R140Q and R172K) proteins containing N-terminal His-tag are expressed in E. coli and purified using ni...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details
US Patent

LigandPNGBDBM448737((S)-3-(2-(((S)-1-(4-((4- acryloylpiperazin-1- yl)m...)
Affinity DataIC50: 46.6nMAssay Description:IDH1 mutant (R132H and R132C) and IDH2 mutant (R140Q and R172K) proteins containing N-terminal His-tag are expressed in E. coli and purified using ni...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Eli Lilly

US Patent
LigandPNGBDBM448737((S)-3-(2-(((S)-1-(4-((4- acryloylpiperazin-1- yl)m...)
Affinity DataIC50: 2.46E+3nMAssay Description:Wild-Type IDH1: Enzymes catalyze the conversion of isocitrate to αKG. Wild-type IDH1 (National Center for Biotechnology Information, Accession: ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details
US Patent