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Target
Interleukin-1 receptor-associated kinase 4
Ligand
BDBM188811
Substrate
n/a
Meas. Tech.
Kinase Assay
pH
7.2±n/a
IC50
<100±n/a nM
Comments
extracted
Citation
 McElroy, WT; Li, G; Ho, GD; Tan, Z; Paliwal, S; Seganish, WM; Tulshian, D; Lampe, J; Methot, JL; Zhou, H; Altman, MD; Zhu, L Amidopyrazole inhibitors of interleukin receptor-associated kinases US Patent  US9169260 Publication Date 10/27/2015 
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:
BDBM188811
Synonyms:
US9169260, 77
Type:
Small organic molecule
Emp. Form.:
C24H23F2N7O
Mol. Mass.:
463.4825
SMILES:
Fc1cc(cc(F)c1-n1nc(cc1NC(=O)c1cnn2cccnc12)C1CCNCC1)C1CC1 |(.43,3.1,;1.92,2.71,;3.01,3.79,;4.5,3.4,;4.89,1.91,;3.81,.82,;4.2,-.67,;2.32,1.22,;1.23,.13,;1.23,-1.41,;-.24,-1.89,;-1.14,-.64,;-.24,.61,;-.63,2.09,;-2.12,2.49,;-3.21,1.4,;-2.52,3.98,;-2.04,5.44,;-3.29,6.35,;-4.54,5.44,;-6.04,5.76,;-7.07,4.62,;-6.6,3.15,;-5.09,2.83,;-4.06,3.98,;-.63,-3.37,;-2.12,-3.77,;-2.52,-5.26,;-1.43,-6.35,;.06,-5.95,;.46,-4.46,;5.59,4.49,;7.07,4.88,;5.98,5.97,)|
Structure:
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