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TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H]
LigandBDBM287893
Substrate/Competitorn/a
Meas. Tech.R132H IDH1 Enzymatic Assay
IC50 18.0±n/a nM
Citation Fischer, CBogen, SLChilders, MLFradera Llinas, FXEllis, JMEsposite, SHoffman, DMHuang, CKattar, SDKim, AJLampe, JWMachacek, MRMcMasters, DRParker, Jr., DLReutershan, MHSciammetta, NShao, PPSloman, DLSun, WUjjainwalla, FWu, ZYu, YGibeau, CR Tricyclic compounds as inhibitors of mutant IDH enzymes US Patent US10508108 Publication Date 12/17/2019
More Info.:Get all data from this article,  Assay Method
 
Isocitrate dehydrogenase [NADP] cytoplasmic [R132H]
Name:Isocitrate dehydrogenase [NADP] cytoplasmic [R132H]
Synonyms:Cytosolic NADP-isocitrate dehydrogenase (IDH1)(R132H) | IDH1 | IDH1 R132H | IDH1(R132H) | IDHC_HUMAN | Isocitrate dehydrogenase (IDH1)(R132H) | Isocitrate dehydrogenase 1 mutant (R132H) | Isocitrate dehydrogenase [NADP] cytoplasmic (IDH)(R132H) | Isocitrate dehydrogenase [NADP] cytoplasmic (IDH1)(R132H) | Isocitrate dehydrogenase [NADP] cytoplasmic (R132H) | PICD
Type:Protein
Mol. Mass.:46641.74
Organism:Homo sapiens (Human)
Description:Human IDH1 R132H (SEQ ID No. 2 in patent). First three are removed. Google patent parsed wrong.
Residue:414
Sequence:
MSKKISGGSVVEMQGDEMTRIIWELIKEKLIFPYVELDLHSYDLGIENRDATNDQVTKDA
AEAIKKHNVGVKCATITPDEKRVEEFKLKQMWKSPNGTIRNILGGTVFREAIICKNIPRL
VSGWVKPIIIGHHAYGDQYRATDFVVPGPGKVEITYTPSDGTQKVTYLVHNFEEGGGVAM
GMYNQDKSIEDFAHSSFQMALSKGWPLYLSTKNTILKKYDGRFKDIFQEIYDKQYKSQFE
AQKIWYEHRLIDDMVAQAMKSEGGFIWACKNYDGDVQSDSVAQGYGSLGMMTSVLVCPDG
KTVEAEAAHGTVTRHYRMYQKGQETSTNPIASIFAWTRGLAHRAKLDNNKELAFFANALE
EVSIETIEAGFMTKDLAACIKGLPNVQRSDYLNTFEFMDKLGENLKIKLAQAKL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM287893
n/a
NameBDBM287893
Synonyms:2-Ethoxy-11-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-ylcarbonyl)-10,11-dihydro-5H-dipyrido[2,3-b:2′,3′-e][1,4]diazepine | US10086000, Example 110 | US10508108, Example 110
TypeSmall organic molecule
Emp. Form.C25H26N4O2
Mol. Mass.414.4995
SMILESCCOc1ccc2Nc3ncccc3CN(C(=O)C3CCc4ccccc4CC3)c2n1
Structure
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