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Target
Interleukin-1 receptor-associated kinase 4
Ligand
BDBM50589413
Substrate
n/a
Meas. Tech.
ChEMBL_2193539 (CHEMBL5105899)
IC50
98±n/a nM
Citation
 Chen, Y; Tso, K; Heckrodt, TJ; Li, H; Yen, R; Lin, N; Singh, R; Taylor, V; Masuda, ES; Park, G; Payan, DG Bicyclic pyrimidine compounds as potent IRAK4 inhibitors. Bioorg Med Chem Lett 73:0 (2022) [PubMed] 
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:
BDBM50589413
Synonyms:
CHEMBL5187947
Type:
Small organic molecule
Emp. Form.:
C24H26FN5OS
Mol. Mass.:
451.56
SMILES:
[H][C@@]12CC[C@@]([H])(C1)C(C2)Nc1nc(Nc2cccc(c2)C(=O)N2CCC(F)C2)nc2ccsc12 |r|
Structure:
Search PDB for entries with ligand similarity: