Reaction Details | |||
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Target | Tumor necrosis factor | ||
Ligand | BDBM407922 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | IRAK4 Monocyte TNFalpha Cell Based Assay | ||
EC50 | 6.00±n/a nM | ||
Citation | Bacon, EM; Brizgys, G; Chin, E; Chou, C; Cottell, JJ; Link, JO; Taylor, JG; Tse, WC; Wright, NE; Yang, Z; Zhang, JR; Zipfel, SM Pyrrolo[1,2-b]pyridazine derivatives US Patent US10336762 Publication Date 7/2/2019 | ||
More Info.: | Get all data from this article, Assay Method | ||
Tumor necrosis factor | |||
Name: | Tumor necrosis factor | ||
Synonyms: | Cachectin | TNF | TNF-a | TNF-alpha | TNFA | TNFA_HUMAN | TNFSF2 | Tumor necrosis factor (TNF-alpha) | Tumor necrosis factor (TNFa) | Tumor necrosis factor alpha (TNFα) | Tumor necrosis factor ligand superfamily member 2 | Tumor necrosis factor, membrane form | Tumor necrosis factor, soluble form | tumor necrosis factor alpha | ||
Type: | Enzyme | ||
Mol. Mass.: | 25645.11 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P01375 | ||
Residue: | 233 | ||
Sequence: |
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BDBM407922 | |||
n/a | |||
Name | BDBM407922 | ||
Synonyms: | US10336762, Compound 867 | methyl-d3 (((1R,3r)-3-((2- (3-cyanopyrrolo[1,2-b] pyridazin-7-yl)-5-(((R)-2- fluoro-3-hydroxy-3- methylbutyl)carbamoyl) pyridin-4-yl)amino)cyclo- butyl)methyl)carbamate | ||
Type | Small organic molecule | ||
Emp. Form. | C26H30FN7O4 | ||
Mol. Mass. | 523.5593 | ||
SMILES | COC(=O)NC[C@H]1C[C@@H](C1)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-c1ccc2cc(cnn12)C#N |r,wU:6.5,21.23,wD:8.10,(8.95,3.78,;7.61,3.01,;6.28,3.78,;6.28,5.32,;4.94,3.01,;3.61,3.78,;2.28,3.01,;1.88,1.52,;.39,1.92,;.79,3.41,;-.94,1.15,;-.94,-.39,;.39,-1.16,;.39,-2.7,;-.94,-3.47,;-2.28,-2.7,;-2.28,-1.16,;-3.61,-.39,;-3.61,1.15,;-4.94,-1.16,;-6.28,-.39,;-7.61,-1.16,;-7.61,-2.7,;-8.95,-.39,;-10.28,-1.16,;-8.95,1.15,;-10.28,.38,;1.72,-3.47,;1.89,-5,;3.39,-5.32,;4.16,-3.99,;5.67,-3.67,;6.14,-2.2,;5.11,-1.06,;3.61,-1.38,;3.13,-2.84,;7.63,-1.8,;9.12,-1.4,)| | ||
Structure |