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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Dual specificity protein kinase TTK | ||
| Ligand | BDBM50569969 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2157241 (CHEMBL5041901) | ||
| Kd | 0.700000±n/a nM | ||
| Citation |  Lu, J; Huang, Y; Huang, J; He, R; Huang, M; Lu, X; Xu, Y; Zhou, F; Zhang, Z; Ding, K Discovery of the First Examples of Threonine Tyrosine Kinase PROTAC Degraders. J Med Chem65:2313-2328 (2022) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Dual specificity protein kinase TTK | |||
| Name: | Dual specificity protein kinase TTK | ||
| Synonyms: | Dual specificity protein kinase (TTK) | Dual specificity protein kinase TTK (MPS1) | MPS1 | MPS1L1 | Monopolar Spindle 1 (MPS1) | Monopolar Spindle 1 (Mps-1) | Monopolar Spindle 1 Kinase (MPS1) | Phosphotyrosine picked threonine-protein kinase (MPS1) | TTK | TTK_HUMAN | ||
| Type: | Protein | ||
| Mol. Mass.: | 97086.79 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P33981 | ||
| Residue: | 857 | ||
| Sequence: |
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| BDBM50569969 | |||
| n/a | |||
| Name | BDBM50569969 | ||
| Synonyms: | CHEMBL4857210 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C29H39N7O3 | ||
| Mol. Mass. | 533.6651 | ||
| SMILES | CCC(=O)N[C@H]1CC[C@H](CC1)n1c2nc(Nc3ccc(cc3OC)N3CCN(C)CC3)ncc2c(C)cc1=O |r,wU:8.11,5.4,(32.47,-21.95,;32.48,-23.49,;31.15,-24.27,;31.17,-25.81,;29.81,-23.52,;29.8,-21.98,;28.46,-21.22,;28.44,-19.68,;29.77,-18.9,;31.11,-19.65,;31.12,-21.19,;29.76,-17.36,;28.42,-16.6,;27.09,-17.38,;25.75,-16.61,;24.42,-17.4,;23.08,-16.64,;23.07,-15.1,;21.73,-14.34,;20.4,-15.12,;20.42,-16.66,;21.75,-17.42,;21.77,-18.96,;20.44,-19.74,;19.06,-14.37,;17.73,-15.15,;16.39,-14.39,;16.38,-12.85,;15.04,-12.09,;17.71,-12.07,;19.04,-12.83,;25.73,-15.07,;27.06,-14.29,;28.41,-15.06,;29.73,-14.28,;29.72,-12.74,;31.07,-15.03,;31.09,-16.57,;32.42,-17.33,)| | ||
| Structure | 
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