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Target
Interleukin-1 receptor-associated kinase 4
Ligand
BDBM394061
Substrate
n/a
Meas. Tech.
Kinase Assay
IC50
2.00±n/a nM
Citation
 Altman, MD; Andresen, BM; Brubaker, JD; Childers, ML; Donofrio, A; Fischmann, T; Gibeau, CR; Kattar, SD; Lesburg, CA; Lim, J; MacLean, JK; Mansoor, UF; Northrup, AB; Sanders, JM; Torres, L Inhibitors of IRAK4 activity US Patent  US9969749 Publication Date 5/15/2018 
Target
Name:
Interleukin-1 receptor-associated kinase 4
Synonyms:
IRAK-4 | IRAK4 | IRAK4_HUMAN | Interleukin-1 receptor-associated kinase 4 (IRAK-4) | Interleukin-1 receptor-associated kinase 4 (IRAK4) | Renal carcinoma antigen NY-REN-64
Type:
Protein
Mol. Mass.:
51519.08
Organism:
Homo sapiens (Human)
Description:
Q9NWZ3
Residue:
460
Sequence:
MNKPITPSTYVRCLNVGLIRKLSDFIDPQEGWKKLAVAIKKPSGDDRYNQFHIRRFEALLQTGKSPTSELLFDWGTTNCTVGDLVDLLIQNEFFAPASLLLPDAVPKTANTLPSKEAITVQQKQMPFCDKDRTLMTPVQNLEQSYMPPDSSSPENKSLEVSDTRFHSFSFYELKNVTNNFDERPISVGGNKMGEGGFGVVYKGYVNNTTVAVKKLAAMVDITTEELKQQFDQEIKVMAKCQHENLVELLGFSSDGDDLCLVYVYMPNGSLLDRLSCLDGTPPLSWHMRCKIAQGAANGINFLHENHHIHRDIKSANILLDEAFTAKISDFGLARASEKFAQTVMTSRIVGTTAYMAPEALRGEITPKSDIYSFGVVLLEIITGLPAVDEHREPQLLLDIKEEIEDEEKTIEDYIDKKMNDADSTSVEAMYSVASQCLHEKKNKRPDIKKVQQLLQEMTAS
  
Inhibitor
Name:
BDBM394061
Synonyms:
6-[5- (methylamino)pyridin-3- yl]-N-{trans-4-[(3R)-3- (morpholin-4- ylmethyl)piperidin-1- yl]cyclohexyl}quinazolin- 4-amine | US9969749, Example 5-11
Type:
Small organic molecule
Emp. Form.:
C30H41N7O
Mol. Mass.:
515.6928
SMILES:
CNc1cncc(c1)-c1ccc2ncnc(N[C@H]3CC[C@@H](CC3)N3CCC[C@H](CN4CCOCC4)C3)c2c1 |r,wU:20.24,27.29,wD:17.17,(.38,9.34,;-.38,8,;-1.93,8,;-2.69,9.34,;-4.23,9.34,;-5,8,;-4.23,6.67,;-2.69,6.67,;-5,5.33,;-6.54,5.33,;-7.31,4,;-6.54,2.67,;-7.31,1.33,;-6.54,,;-5,,;-4.23,1.33,;-2.69,1.33,;-1.93,,;-2.7,-1.33,;-1.93,-2.67,;-.39,-2.67,;.38,-1.33,;-.39,,;.38,-4,;-.39,-5.33,;.38,-6.67,;1.92,-6.67,;2.69,-5.33,;4.23,-5.33,;5,-6.67,;4.24,-8,;5,-9.34,;6.54,-9.34,;7.31,-8,;6.54,-6.67,;1.92,-4,;-5,2.67,;-4.23,4,)|
Structure:
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