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Target
Non-receptor tyrosine-protein kinase TYK2 [580-1182]
Ligand
BDBM420028
Substrate
n/a
Meas. Tech.
Enzymatic Inhibition Assay
IC50
<0.200±n/a nM
Citation
 Kreutter, KD; Leonard, K; Rizzolio, MC; Smith, RC; Tichenor, MS; Wang, A Small molecule inhibitors of the JAK family of kinases US Patent  US10487083 Publication Date 11/26/2019 
Target
Name:
Non-receptor tyrosine-protein kinase TYK2 [580-1182]
Synonyms:
TYK2 | TYK2 (aa 580-1182) | TYK2_HUMAN
Type:
n/a
Mol. Mass.:
68754.63
Organism:
Homo sapiens (Human)
Description:
P29597[580-1182]
Residue:
608
Sequence:
SFHRVDQKEITQLSHLGQGTRTNVYEGRLRVEGSGDPEEGKMDDEDPLVPGRDRGQELRVVLKVLDPSHHDIALAFYETASLMSQVSHTHLAFVHGVCVRGPENIMVTEYVEHGPLDVWLRRERGHVPMAWKMVVAQQLASALSYLENKNLVHGNVCGRNILLARLGLAEGTSPFIKLSDPGVGLGALSREERVERIPWLAPECLPGGANSLSTAMDKWGFGATLLEICFDGEAPLQSRSPSEKEHFYQRQHRLPEPSCPQLATLTSQCLTYEPTQRPSFRTILRDLTRLQPHNLADVLTVNPDSPASDPTVFHKRYLKKIRDLGEGHFGKVSLYCYDPTNDGTGEMVAVKALKADCGPQHRSGWKQEIDILRTLYHEHIIKYKGCCEDQGEKSLQLVMEYVPLGSLRDYLPRHSIGLAQLLLFAQQICEGMAYLHAQHYIHRDLAARNVLLDNDRLVKIGDFGLAKAVPEGHEYYRVREDGDSPVFWYAPECLKEYKFYYASDVWSFGVTLYELLTHCDSSQSPPTKFLELIGIAQGQMTVLRLTELLERGERLPRPDKCPCEVYHLMKNCWETEASFRPTFENLIPILKTVHEKYQGQAPSVFSVC
  
Inhibitor
Name:
BDBM420028
Synonyms:
US10487083, Example B
Type:
Small organic molecule
Emp. Form.:
C18H21N5O
Mol. Mass.:
323.3922
SMILES:
OCCc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:18.21,wD:15.17,(-6.63,-10.86,;-5.86,-12.2,;-4.32,-12.2,;-3.55,-13.53,;-4.18,-14.94,;-3.04,-15.97,;-3.04,-17.51,;-1.7,-18.28,;-.37,-17.51,;1.1,-17.98,;2,-16.74,;1.1,-15.49,;-.37,-15.97,;-1.7,-15.2,;-2.02,-13.69,;-.93,-12.6,;.55,-13,;1.64,-11.91,;1.25,-10.42,;2.33,-9.33,;3.87,-9.33,;5.41,-9.33,;-.24,-10.03,;-1.33,-11.11,)|
Structure:
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