Reaction Details |
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Target | Isocitrate dehydrogenase [NADP] cytoplasmic [R132H] |
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Ligand | BDBM416203 |
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Substrate/Competitor | n/a |
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Meas. Tech. | Enzymatic Assay |
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IC50 | 12.0±n/a nM |
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Citation | Fischer, C; Bogen, SL; Childers, ML; Fradera Llinas, FX; Ellis, JM; Esposite, S; Hong, Q; Huang, C; Kim, AJ; Lampe, JW; Machacek, MR; McMasters, DR; Otte, RD; Parker, Jr., DL; Reutershan, M; Sciammetta, N; Shao, PP; Sloman, DL; Ujjainwalla, F; White, C; Wu, Z; Yu, Y; Zhao, K; Gibeau, C; Biftu, T; Biju, P; Chen, L; Close, J; Fuller, PH; Huang, X; Park, MK; Simov, V; Witter, DJ; Zhang, H Tricyclic compounds as inhibitors of mutant IDH enzymes US Patent US10442819 Publication Date 10/15/2019 |
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More Info.: | Get all data from this article, Assay Method |
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Isocitrate dehydrogenase [NADP] cytoplasmic [R132H] |
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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
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BDBM416203 |
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n/a |
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Name | BDBM416203 |
Synonyms: | 8-[(1S,4S)-1-methyl-2-oxa-5- azabicyclo[2.2.1]hept-5-yl]-6- {[1-(2,2,2- trifluoroethyl)piperidin-4- yl]carbonyl}-6,11-dihydro- 5H-pyrido[2,3- b][1,5]benzodiazepine | US10442819, Example 348 |
Type | Small organic molecule |
Emp. Form. | C26H30F3N5O2 |
Mol. Mass. | 501.5439 |
SMILES | C[C@@]12C[C@@H](CO1)N(C2)c1ccc2Nc3ncccc3CN(C(=O)C3CCN(CC(F)(F)F)CC3)c2c1 |r| |
Structure |
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