BDBM50458781 CHEMBL4214694

SMILES CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2nc(no2)-c2ccc(Cl)cc2)n1

InChI Key InChIKey=PEEWKHRIJDGILX-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 = 50458781   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Novartis Institutes For Biomedical Research

Curated by ChEMBL
LigandPNGBDBM50458781(CHEMBL4214694)
Affinity DataIC50: 36nMAssay Description:Inhibition of IDH1 R132H mutant (unknown origin) using alphaKG as substrate in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed