Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetTyrosine-protein kinase BTK
LigandBDBM350165
Substrate/Competitorn/a
Meas. Tech.Btk Enzyme Activity Assay
IC50 11.4±n/a nM
Citation Liu, JKozlowski, JAAndresen, BMBoga, SBGao, XGuiadeen, DGCai, JLiu, SWang, DWu, HYang, C Tertiary alcohol imidazopyrazine BTK inhibitors US Patent US10208047 Publication Date 2/19/2019  Article
More Info.:Get all data from this article,  Assay Method
 
Tyrosine-protein kinase BTK
Name:Tyrosine-protein kinase BTK
Synonyms:ATK | Agammaglobulinaemia tyrosine kinase | Agammaglobulinemia tyrosine kinase | B cell progenitor kinase | B-cell progenitor kinase | BPK | BTK | Bruton tyrosine kinase | Tyrosine Kinase BTK | Tyrosine-protein 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:
MAAVILESIFLKRSQQKKKTSPLNFKKRLFLLTVHKLSYYEYDFERGRRGSKKGSIDVEK
ITCVETVVPEKNPPPERQIPRRGEESSEMEQISIIERFPYPFQVVYDEGPLYVFSPTEEL
RKRWIHQLKNVIRYNSDLVQKYHPCFWIDGQYLCCSQTAKNAMGCQILENRNGSLKPGSS
HRKTKKPLPPTPEEDQILKKPLPPEPAAAPVSTSELKKVVALYDYMPMNANDLQLRKGDE
YFILEESNLPWWRARDKNGQEGYIPSNYVTEAEDSIEMYEWYSKHMTRSQAEQLLKQEGK
EGGFIVRDSSKAGKYTVSVFAKSTGDPQGVIRHYVVCSTPQSQYYLAEKHLFSTIPELIN
YHQHNSAGLISRLKYPVSQQNKNAPSTAGLGYGSWEIDPKDLTFLKELGTGQFGVVKYGK
WRGQYDVAIKMIKEGSMSEDEFIEEAKVMMNLSHEKLVQLYGVCTKQRPIFIITEYMANG
CLLNYLREMRHRFQTQQLLEMCKDVCEAMEYLESKQFLHRDLAARNCLVNDQGVVKVSDF
GLSRYVLDDEYTSSVGSKFPVRWSPPEVLMYSKFSSKSDIWAFGVLMWEIYSLGKMPYER
FTNSETAEHIAQGLRLYRPHLASEKVYTIMYSCWHEKADERPTFKILLSNILDVMDEES
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM350165
NameBDBM350165
Synonyms:4-[8-amino-1-(4-{(1R)-1- [3-(difluoromethyl)phenyl]- 1- hydroxyethyl}phenyl)imidazo [1,5-a]pyrazin-3-yl]-1,4- dimethylcyclohexane- carboxylic acid | US10208047, Example 33
TypeSmall organic molecule
Emp. Form.C30H32F2N4O3
Mol. Mass.534.5969
SMILESC[C@@](O)(c1ccc(cc1)-c1nc(n2ccnc(N)c12)C1(C)CCC(C)(CC1)C(O)=O)c1cccc(c1)C(F)F |r,wU:1.0,wD:1.1,(3.86,5.51,;2.38,5.91,;3.47,7,;1.98,4.42,;3.07,3.33,;2.67,1.84,;1.18,1.45,;.09,2.53,;.49,4.02,;.78,-.04,;1.69,-1.29,;.78,-2.53,;-.68,-2.06,;-2.02,-2.83,;-3.35,-2.06,;-3.35,-.52,;-2.02,.25,;-2.02,1.79,;-.68,-.52,;1.18,-4.02,;-.31,-3.62,;.09,-5.11,;.49,-6.6,;1.98,-7,;3.47,-7.4,;3.07,-5.91,;2.67,-4.42,;2.38,-8.48,;1.29,-9.57,;3.86,-8.88,;1.29,7,;1.69,8.48,;.6,9.57,;-.89,9.17,;-1.29,7.69,;-.2,6.6,;-2.78,7.29,;-3.86,8.38,;-3.17,5.8,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a