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Target
Tyrosine-protein kinase BTK
Ligand
BDBM350154
Substrate
n/a
Meas. Tech.
Btk Enzyme Activity Assay
IC50
6.20±n/a nM
Citation
 Liu, J; Kozlowski, JA; Andresen, BM; Boga, SB; Gao, X; Guiadeen, DG; Cai, J; Liu, S; Wang, D; Wu, H; Yang, C Tertiary alcohol imidazopyrazine BTK inhibitors US Patent  US10208047 Publication Date 2/19/2019 
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:
BDBM350154
Synonyms:
5-[8-amino-1-(4-{(1R)-1- hydroxy-1-[3- (trifluoromethyl)phenyl] ethyl}phenyl)imidazo[1,5- a]pyrazin-3- yl]tricyclo[3.2.2.0~2,4~] nonane-1-carboxylic acid | US10208047, Example 22
Type:
Small organic molecule
Emp. Form.:
C31H29F3N4O3
Mol. Mass.:
562.5822
SMILES:
C[C@@](O)(c1ccc(cc1)-c1nc(n2ccnc(N)c12)C12CCC(CC1)(C1CC21)C(O)=O)c1cccc(c1)C(F)(F)F |r,wU:1.0,wD:1.1,(2.18,6.06,;.64,6.06,;1.41,7.39,;.64,4.52,;1.97,3.75,;1.97,2.21,;.64,1.44,;-.69,2.21,;-.69,3.75,;.64,-.1,;1.89,-1.01,;1.41,-2.47,;-.13,-2.47,;-1.16,-3.62,;-2.67,-3.3,;-3.14,-1.83,;-2.11,-.69,;-2.51,.8,;-.61,-1.01,;2.18,-3.8,;3.72,-3.8,;4.49,-5.14,;3.72,-6.47,;3.72,-5.32,;3.14,-4.36,;2.18,-6.47,;.64,-6.47,;1.41,-5.14,;4.49,-7.81,;6.03,-7.81,;3.72,-9.14,;-.69,6.83,;-.69,8.37,;-2.03,9.14,;-3.36,8.37,;-3.36,6.83,;-2.03,6.06,;-4.7,6.06,;-6.03,6.83,;-4.7,4.52,;-6.03,5.29,)|
Structure:
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