BDBM412548 US10399972, Example 39

SMILES CO[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2Nc3ncc(F)cc3CN(C(=O)[C@H]3CC[C@@H](CO3)OC(C)C)c2c1

InChI Key InChIKey=QGIRHEBZBQTKKE-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 = 412548   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM412548(US10399972, Example 39)
Affinity DataIC50: 10.4nMAssay Description:Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series. 125 nL of each dilution or DMSO alone is disp...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
7/27/2020
Entry Details
US Patent