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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | RAC-alpha serine/threonine-protein kinase | ||
| Ligand | BDBM50528461 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1904982 (CHEMBL4407340) | ||
| IC50 | 2.7±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: |
| ||
| BDBM50528461 | |||
| n/a | |||
| Name | BDBM50528461 | ||
| Synonyms: | CHEMBL4517950 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H22Cl4N4O3 | ||
| Mol. Mass. | 532.247 | ||
| SMILES | Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:24.27,(72.74,-6.97,;72.42,-8.47,;71.01,-9.1,;71.17,-10.63,;72.67,-10.95,;73.3,-12.36,;73.45,-9.62,;74.98,-9.46,;76.01,-10.61,;77.43,-9.98,;77.26,-8.45,;75.76,-8.13,;75.13,-6.72,;78.76,-10.76,;78.75,-12.3,;80.09,-9.99,;81.42,-10.77,;81.42,-12.3,;82.75,-13.08,;84.09,-12.31,;85.42,-13.08,;86.76,-12.32,;88.09,-13.09,;84.1,-10.76,;82.76,-10,;82.76,-8.47,;81.43,-7.7,;81.43,-6.15,;82.76,-5.38,;82.75,-3.84,;84.09,-6.15,;85.42,-5.37,;84.1,-7.7,)| | ||
| Structure | 
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