Reaction Details Report a problem with these data
Target
Tyrosine-protein kinase BTK
Ligand
BDBM294109
Substrate
n/a
Meas. Tech.
Human Recombinant Btk Enzyme Assay
IC50
0.340±n/a nM
Citation
 Batt, DG; Bertrand, MB; De Lucca, GV; Galella, MA; Ko, SS; Langevine, CM; Liu, Q; Shi, Q; Srivastava, AS; Tino, JA; Watterson, SH Substituted tetrahydrocarbazole and carbazole carboxamide compounds US Patent  US10435415 Publication Date 10/8/2019 
Target
Name:
Tyrosine-protein kinase BTK
Synonyms:
AGMX1 | ATK | Agammaglobulinaemia tyrosine kinase | Agammaglobulinemia tyrosine kinase | B cell progenitor kinase | B-cell progenitor kinase | BPK | BTK | BTK_HUMAN | Bruton tyrosine kinase | Tyrosine Kinase BTK | Tyrosine-protein kinase (BTK) | Tyrosine-protein kinase BTK (BTK)
Type:
Enzyme
Mol. Mass.:
76289.95
Organism:
Homo sapiens (Human)
Description:
Q06187
Residue:
659
Sequence:
MAAVILESIFLKRSQQKKKTSPLNFKKRLFLLTVHKLSYYEYDFERGRRGSKKGSIDVEKITCVETVVPEKNPPPERQIPRRGEESSEMEQISIIERFPYPFQVVYDEGPLYVFSPTEELRKRWIHQLKNVIRYNSDLVQKYHPCFWIDGQYLCCSQTAKNAMGCQILENRNGSLKPGSSHRKTKKPLPPTPEEDQILKKPLPPEPAAAPVSTSELKKVVALYDYMPMNANDLQLRKGDEYFILEESNLPWWRARDKNGQEGYIPSNYVTEAEDSIEMYEWYSKHMTRSQAEQLLKQEGKEGGFIVRDSSKAGKYTVSVFAKSTGDPQGVIRHYVVCSTPQSQYYLAEKHLFSTIPELINYHQHNSAGLISRLKYPVSQQNKNAPSTAGLGYGSWEIDPKDLTFLKELGTGQFGVVKYGKWRGQYDVAIKMIKEGSMSEDEFIEEAKVMMNLSHEKLVQLYGVCTKQRPIFIITEYMANGCLLNYLREMRHRFQTQQLLEMCKDVCEAMEYLESKQFLHRDLAARNCLVNDQGVVKVSDFGLSRYVLDDEYTSSVGSKFPVRWSPPEVLMYSKFSSKSDIWAFGVLMWEIYSLGKMPYERFTNSETAEHIAQGLRLYRPHLASEKVYTIMYSCWHEKADERPTFKILLSNILDVMDEES
  
Inhibitor
Name:
BDBM294109
Synonyms:
US10106559, Example 66 | US10435415, Example 66 | US9850258, Example 66
Type:
Small organic molecule
Emp. Form.:
C32H27FN4O4
Mol. Mass.:
550.5796
SMILES:
Cc1cc(C(N)=O)c2[nH]c3cc(ccc3c2c1-c1cccc(c1C)-n1c(=O)[nH]c2c(F)cccc2c1=O)C(C)(C)O |(2.91,1.54,;1.58,2.31,;1.58,3.85,;.24,4.62,;.24,6.16,;1.58,6.93,;-1.09,6.93,;-1.09,3.85,;-2.55,4.33,;-3.46,3.08,;-4.99,2.92,;-5.62,1.51,;-4.71,.27,;-3.18,.43,;-2.55,1.83,;-1.09,2.31,;.24,1.54,;.24,,;-1.09,-.77,;-1.09,-2.31,;.24,-3.08,;1.58,-2.31,;1.58,-.77,;1.98,.72,;2.91,-3.08,;2.91,-4.62,;1.58,-5.39,;4.25,-5.39,;5.58,-4.62,;6.91,-5.39,;6.91,-6.93,;8.25,-4.62,;8.25,-3.08,;6.91,-2.31,;5.58,-3.08,;4.25,-2.31,;4.25,-.77,;-7.16,1.51,;-8.25,.42,;-6.76,.02,;-7.93,2.85,)|
Structure:
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