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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | RAC-alpha serine/threonine-protein kinase | ||
| Ligand | BDBM50528468 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1904982 (CHEMBL4407340) | ||
| IC50 | 3.4±n/a nM | ||
| Citation |  Dong, X; Zhan, W; Zhao, M; Che, J; Dai, X; Wu, Y; Xu, L; Zhou, Y; Zhao, Y; Tian, T; Cheng, G; Jin, Z; Li, J; Shao, Y; He, Q; Yang, B; Weng, Q; Hu, Y Discovery of 3,4,6-Trisubstituted Piperidine Derivatives as Orally Active, Low hERG Blocking Akt Inhibitors via Conformational Restriction and Structure-Based Design. J Med Chem62:7264-7288 (2019) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| RAC-alpha serine/threonine-protein kinase | |||
| Name: | RAC-alpha serine/threonine-protein kinase | ||
| Synonyms: | AKT phosphorylation (p-AKT) | AKT1 | AKT1/PPP1CA | AKT1_HUMAN | C-AKT | PKB | PKB alpha | Protein kinase Akt-1 | Protein kinase B | Protein kinase B (AKT1) | Protein kinase B (Akt 1) | Protein kinase B (Akt) | Protein kinase B alpha | Protein kinase B alpha (AKT1) | Proto-oncogene Akt (Akt1) | Proto-oncogene c-Akt (AKT) | Proto-oncogene c-Akt (AKT1) | RAC | RAC-PK-alpha | RAC-alpha serine/threonine-protein kinase (AKT) | RAC-alpha serine/threonine-protein kinase (AKT1) | RAC-alpha serine/threonine-protein kinase (pAKT) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 55681.25 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P31749 | ||
| Residue: | 480 | ||
| Sequence: |
| ||
| BDBM50528468 | |||
| n/a | |||
| Name | BDBM50528468 | ||
| Synonyms: | CHEMBL4590906 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H27Cl4N5O2 | ||
| Mol. Mass. | 559.315 | ||
| SMILES | CN(C)CC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 |r,wU:8.11,5.4,wD:7.29,(76.96,-26.16,;75.63,-26.92,;75.62,-28.46,;74.3,-26.15,;72.96,-26.91,;71.63,-26.14,;71.64,-24.59,;70.3,-23.83,;68.97,-24.59,;68.96,-26.13,;70.29,-26.9,;67.63,-23.82,;66.3,-24.59,;66.29,-26.13,;64.97,-23.81,;63.55,-24.44,;62.52,-23.29,;63.3,-21.96,;62.67,-20.55,;64.8,-22.28,;60.99,-23.45,;60.21,-24.78,;60.84,-26.19,;58.71,-24.46,;58.55,-22.92,;59.96,-22.3,;60.28,-20.8,;70.3,-22.3,;68.97,-21.53,;68.97,-19.98,;70.3,-19.21,;70.29,-17.67,;71.63,-19.97,;72.96,-19.2,;71.64,-21.52,)| | ||
| Structure | 
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