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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | RAC-alpha serine/threonine-protein kinase | ||
| Ligand | BDBM50528429 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1904982 (CHEMBL4407340) | ||
| IC50 | 2.6±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: |
| ||
| BDBM50528429 | |||
| n/a | |||
| Name | BDBM50528429 | ||
| Synonyms: | CHEMBL4475923 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H23Cl4N5O3 | ||
| Mol. Mass. | 559.272 | ||
| SMILES | CNC(=O)C[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,(50.5,-29.31,;49.16,-30.08,;47.83,-29.31,;47.83,-27.77,;46.49,-30.07,;45.16,-29.3,;45.17,-27.75,;43.84,-26.98,;42.5,-27.75,;42.49,-29.29,;43.82,-30.06,;41.17,-26.98,;39.83,-27.74,;39.83,-29.28,;38.5,-26.97,;37.08,-27.59,;36.06,-26.45,;36.83,-25.12,;36.21,-23.71,;38.34,-25.44,;34.52,-26.61,;33.75,-27.94,;34.37,-29.35,;32.24,-27.61,;32.09,-26.08,;33.49,-25.46,;33.82,-23.95,;43.83,-25.45,;42.5,-24.68,;42.5,-23.14,;43.83,-22.37,;43.83,-20.83,;45.17,-23.13,;46.5,-22.36,;45.17,-24.68,)| | ||
| Structure | 
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