Reaction Details | |||
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Target | Non-receptor tyrosine-protein kinase TYK2 | ||
Ligand | BDBM387820 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Enzymatic Inhibition Assay | ||
IC50 | 11.6±n/a nM | ||
Citation | Koudriakova, T; Kreutter, KD; Leonard, K; Rizzolio, MC; Smith, RC; Tichenor, MS; Wang, A Small molecule inhibitors of the JAK family of kinases US Patent US10294226 Publication Date 5/21/2019 | ||
More Info.: | Get all data from this article, Assay Method | ||
Non-receptor tyrosine-protein kinase TYK2 | |||
Name: | Non-receptor tyrosine-protein kinase TYK2 | ||
Synonyms: | Non-receptor tyrosine-protein kinase TYK2 (TYK2) | TYK2 | TYK2_HUMAN | Tyrosine-protein kinase TYK2 | ||
Type: | Protein | ||
Mol. Mass.: | 133666.03 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P29597 | ||
Residue: | 1187 | ||
Sequence: |
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BDBM387820 | |||
n/a | |||
Name | BDBM387820 | ||
Synonyms: | 2-(1-((1r,4r)-4-(Cyanomethyl)cyclohexyl)-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-2-yl)-N-(cyclopropylmethyl)acetamide | US10294226, Compound Ex. 3 | US10487083, Example 3 | US10981911, Example 3 | US11059823, Example 3 | ||
Type | Small organic molecule | ||
Emp. Form. | C22H26N6O | ||
Mol. Mass. | 390.4814 | ||
SMILES | O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NCC1CC1 |r,wU:18.21,wD:15.17,(-5.21,-1.06,;-4.44,.27,;-2.9,.27,;-2.13,-1.06,;-2.75,-2.47,;-1.61,-3.5,;-1.61,-5.04,;-.27,-5.81,;1.06,-5.04,;2.52,-5.52,;3.43,-4.27,;2.52,-3.03,;1.06,-3.5,;-.27,-2.73,;-.59,-1.22,;.44,-.08,;1.94,-.4,;2.97,.74,;2.5,2.21,;3.53,3.35,;5.03,3.03,;6.54,2.72,;.99,2.53,;-.04,1.38,;-5.21,1.6,;-4.44,2.94,;-5.21,4.27,;-5.21,5.81,;-6.54,5.04,)| | ||
Structure |