BDBM278631 (2E)-3-(1-{[5-(1-Cyanocyclobutyl)-3-(2,4,6-trichlorophenyl)-1,2-oxazol-4-yl]carbonyl}-3-methyl-1H-indol-4-yl)prop-2-enoic acid::US10040791, Example 93

SMILES Cc1cn(C(=O)c2c(-c3c(Cl)cc(Cl)cc3Cl)noc2C2(C#N)CCC2)c2cccc(/C=C/C(=O)O)c12

InChI Key InChIKey=LPZYXALZTFWCGH-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 278631   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Daiichi Sankyo

US Patent
LigandChemical structure of BindingDB Monomer ID 278631BDBM278631((2E)-3-(1-{[5-(1-Cyanocyclobutyl)-3-(2,4,6-trichlo...)
Affinity DataIC50: 12nMpH: 7.5 T: 2°CAssay Description:The IDH1R132H protein and the IDH1R132C protein were prepared as follows: the IDH1R132H or IDH1R132C gene was integrated into a pET24b(+) vector (Nov...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2018
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132C](Human)
Daiichi Sankyo

US Patent
LigandChemical structure of BindingDB Monomer ID 278631BDBM278631((2E)-3-(1-{[5-(1-Cyanocyclobutyl)-3-(2,4,6-trichlo...)
Affinity DataIC50: 85nMpH: 7.5 T: 2°CAssay Description:The IDH1R132H protein and the IDH1R132C protein were prepared as follows: the IDH1R132H or IDH1R132C gene was integrated into a pET24b(+) vector (Nov...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2018
Entry Details
US Patent