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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | RAC-alpha serine/threonine-protein kinase | ||
| Ligand | BDBM50528476 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1904982 (CHEMBL4407340) | ||
| IC50 | 8.0±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: |
| ||
| BDBM50528476 | |||
| n/a | |||
| Name | BDBM50528476 | ||
| Synonyms: | CHEMBL4585120 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C21H19Cl2F3N4O2 | ||
| Mol. Mass. | 487.302 | ||
| SMILES | Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(c1)C(F)(F)F |r,wU:16.17,wD:21.24,(26.53,-8.06,;26.2,-9.57,;24.8,-10.19,;24.95,-11.72,;26.46,-12.05,;27.08,-13.45,;27.23,-10.71,;28.77,-10.56,;29.79,-11.71,;31.2,-11.09,;31.05,-9.55,;29.54,-9.23,;28.92,-7.82,;32.53,-11.86,;32.52,-13.4,;33.86,-11.09,;35.19,-11.87,;35.19,-13.4,;36.52,-14.18,;37.86,-13.41,;37.87,-11.86,;36.53,-11.1,;36.54,-9.56,;35.2,-8.79,;35.21,-7.25,;36.54,-6.48,;37.87,-7.24,;37.88,-8.79,;39.2,-6.47,;40.54,-7.23,;39.2,-4.93,;40.53,-5.69,)| | ||
| Structure | 
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