Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Tyrosine-protein kinase JAK1 | ||
Ligand | BDBM113178 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Enzymatic Assay | ||
pH | 7.4±n/a | ||
IC50 | 19.3±n/a nM | ||
Comments | extracted | ||
Citation | Promo, MA; Xie, J; Acker, BA; Hartmann, SJ; Wolfson, SG; Huang, H; Jacobsen, EJ Pyrrolo[2,3-D]pyrimidine compounds US Patent US8633206 Publication Date 1/21/2014 | ||
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: |
| ||
BDBM113178 | |||
n/a | |||
Name | BDBM113178 | ||
Synonyms: | US8633206, 96 | ||
Type | Small organic molecule | ||
Emp. Form. | C25H34N6O3S | ||
Mol. Mass. | 498.641 | ||
SMILES | CN([C@H]1CC[C@H](CS(=O)(=O)N2CC[C@H](COCc3cccnc3)C2)CC1)c1ncnc2[nH]ccc12 |r,wU:5.5,13.13,wD:2.1,(7.49,.53,;6.15,-.24,;4.82,.53,;4.82,2.07,;3.49,2.84,;2.15,2.07,;.82,2.84,;-.51,2.07,;-.51,.53,;.82,1.3,;-1.85,2.84,;-1.83,4.38,;-3.3,4.86,;-4.2,3.61,;-5.69,3.21,;-6.09,1.73,;-7.57,1.33,;-7.97,-.16,;-9.46,-.56,;-9.86,-2.05,;-8.77,-3.14,;-7.28,-2.74,;-6.88,-1.25,;-3.3,2.37,;2.15,.53,;3.49,-.24,;6.15,-1.78,;4.82,-2.55,;4.82,-4.09,;6.15,-4.86,;7.49,-4.09,;8.95,-4.56,;9.86,-3.32,;8.95,-2.07,;7.49,-2.55,)| | ||
Structure |