Reaction Details | |||
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Target | Tyrosine-protein kinase JAK1 [574-1154] | ||
Ligand | BDBM493085 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Enzymatic Inhibition Assay | ||
IC50 | 0.100±n/a nM | ||
Citation | Bacani, GM; Chai, W; Koudriakova, T; Krawczuk, PJ; Kreutter, KD; Leonard, K; Rizzolio, MC; Seierstad, M; Smith, RC; Tichenor, MS; Venable, JD; Wang, A Imidazopyrrolopyridine as inhibitors of the JAK family of kinases US Patent US10981911 Publication Date 4/20/2021 | ||
More Info.: | Get all data from this article, Assay Method | ||
Tyrosine-protein kinase JAK1 [574-1154] | |||
Name: | Tyrosine-protein kinase JAK1 [574-1154] | ||
Synonyms: | JAK1 | JAK1 (aa 574-1154) | JAK1A | JAK1B | JAK1_HUMAN | ||
Type: | Protein | ||
Mol. Mass.: | 66641.39 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P23458[574-1154] | ||
Residue: | 581 | ||
Sequence: |
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BDBM493085 | |||
n/a | |||
Name | BDBM493085 | ||
Synonyms: | 2-((1r,4r)-4-(2-((1H-Pyrazol-5-yl)methyl)imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(6H)-yl)cyclohexyl)acetonitrile | US10981911, Example 25 | ||
Type | Small organic molecule | ||
Emp. Form. | C20H21N7 | ||
Mol. Mass. | 359.4276 | ||
SMILES | N#CC[C@H]1CC[C@@H](CC1)n1c(Cc2ccn[nH]2)nc2cnc3[nH]ccc3c12 |r,wU:3.2,wD:6.9,(6.77,3.67,;5.28,4.07,;3.8,4.47,;2.71,3.38,;3.11,1.9,;2.02,.81,;.53,1.2,;.13,2.69,;1.22,3.78,;-.56,.12,;-2.09,.28,;-2.86,1.62,;-4.4,1.62,;-5.31,.37,;-6.77,.85,;-6.77,2.39,;-5.31,2.86,;-2.72,-1.12,;-1.58,-2.16,;-1.59,-3.7,;-.26,-4.47,;1.08,-3.71,;2.54,-4.19,;3.45,-2.95,;2.55,-1.7,;1.08,-2.17,;-.25,-1.39,)| | ||
Structure |