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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | RAC-alpha serine/threonine-protein kinase | ||
| Ligand | BDBM50528467 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1904982 (CHEMBL4407340) | ||
| IC50 | 4.5±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: |
| ||
| BDBM50528467 | |||
| n/a | |||
| Name | BDBM50528467 | ||
| Synonyms: | CHEMBL4519793 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H23Cl4N7O2 | ||
| Mol. Mass. | 583.297 | ||
| SMILES | Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCn2cncn2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:28.32,(35.98,-7.3,;35.66,-8.81,;34.25,-9.43,;34.4,-10.96,;35.91,-11.29,;36.53,-12.69,;36.68,-9.95,;38.22,-9.79,;39.25,-10.94,;40.66,-10.32,;40.5,-8.79,;38.99,-8.46,;38.37,-7.05,;41.99,-11.09,;41.99,-12.63,;43.33,-10.33,;44.66,-11.1,;44.66,-12.63,;45.99,-13.41,;47.32,-12.64,;48.65,-13.42,;49.99,-12.65,;51.32,-13.43,;51.48,-14.95,;52.99,-15.28,;53.76,-13.95,;52.73,-12.8,;47.33,-11.1,;46,-10.33,;46,-8.8,;44.66,-8.03,;44.66,-6.49,;45.99,-5.72,;45.99,-4.18,;47.33,-6.48,;48.66,-5.7,;47.33,-8.03,)| | ||
| Structure | 
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