Reaction Details | |||
---|---|---|---|
![]() | Report a problem with these data | ||
Target | Isocitrate dehydrogenase [NADP] cytoplasmic [R132H] | ||
Ligand | BDBM412526 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | R132H IDH1 Enzymatic Assay | ||
IC50 | 28.4±n/a nM | ||
Citation | ![]() | ||
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: |
| ||
BDBM412526 | |||
n/a | |||
Name | BDBM412526 | ||
Synonyms: | (3-fluoro-8-((3R,3aR,6R,6aR)- hexahydro-3,6-epiminofuro[3,2- b]furan-7-yl)-5,11-dihydro-6H- benzo[b]pyrido[2,3- e][1,4]diazepin-6-yl)(trans-4- isopropoxycyclohexyl)methanone | US10399972, Example 17 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H33FN4O4 | ||
Mol. Mass. | 508.5844 | ||
SMILES | CC(C)O[C@H]1CC[C@@H](CC1)C(=O)N1Cc2cc(F)cnc2Nc2ccc(cc12)N1[C@@H]2CO[C@@H]3[C@H]1CO[C@H]23 |r,wU:33.37,7.10,wD:29.32,32.35,36.40,4.3,THB:35:36:28.33:31.30,(6.9,2.79,;6.56,4.29,;7.69,5.34,;5.09,4.74,;3.96,3.7,;2.49,4.15,;1.36,3.1,;1.7,1.6,;3.17,1.15,;4.3,2.2,;.57,.55,;-.9,1.01,;.92,-.95,;2.42,-1.29,;3.08,-2.68,;4.62,-2.56,;5.49,-3.83,;7.02,-3.72,;4.82,-5.22,;3.28,-5.34,;2.42,-4.07,;.92,-4.41,;-.29,-3.45,;-1.62,-4.22,;-2.96,-3.45,;-2.96,-1.91,;-1.62,-1.14,;-.29,-1.91,;-4.29,-1.14,;-5.06,-2.47,;-6.36,-3.69,;-7.69,-2.92,;-7.69,-1.38,;-5.38,-.05,;-5.78,1.44,;-7.11,.67,;-6.15,-1.38,)| | ||
Structure | ![]() |