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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Tyrosine-protein kinase JAK1 | ||
| Ligand | BDBM50539830 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1979484 (CHEMBL4612619) | ||
| IC50 | 110±n/a nM | ||
| Citation |  Hansen, BB; Jepsen, TH; Larsen, M; Sindet, R; Vifian, T; Burhardt, MN; Larsen, J; Seitzberg, JG; Carnerup, MA; Jerre, A; Mølck, C; Lovato, P; Rai, S; Nasipireddy, VR; Ritzén, A Fragment-Based Discovery of Pyrazolopyridones as JAK1 Inhibitors with Excellent Subtype Selectivity. J Med Chem63:7008-7032 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Tyrosine-protein kinase JAK1 | |||
| Name: | Tyrosine-protein kinase JAK1 | ||
| Synonyms: | JAK-1 | JAK1 | JAK1A | JAK1B | JAK1_HUMAN | Janus kinase 1 | Janus kinase 1 (JAK1) | Janus kinase 1 JAK1 | ||
| Type: | Protein | ||
| Mol. Mass.: | 133293.73 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P23458 | ||
| Residue: | 1154 | ||
| Sequence: |
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| BDBM50539830 | |||
| n/a | |||
| Name | BDBM50539830 | ||
| Synonyms: | CHEMBL4632897 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H26N4O2 | ||
| Mol. Mass. | 342.4353 | ||
| SMILES | Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@@H](CC3)NC(=O)C3CCCC3)c12 |r,wU:10.9,wD:13.16,(60.58,-12.25,;61.06,-13.71,;60.14,-14.96,;61.06,-16.21,;62.53,-15.73,;63.86,-16.49,;65.19,-15.73,;66.53,-16.5,;65.19,-14.19,;63.86,-13.4,;63.87,-11.86,;62.54,-11.09,;62.55,-9.55,;63.89,-8.79,;65.21,-9.56,;65.21,-11.1,;63.89,-7.25,;62.57,-6.47,;61.23,-7.23,;62.57,-4.93,;63.82,-4.03,;63.35,-2.56,;61.81,-2.56,;61.33,-4.02,;62.53,-14.19,)| | ||
| Structure | 
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