Target
Interleukin-1 receptor-associated kinase 4
Ligand
BDBM50612200
Substrate
n/a
Meas. Tech.
ChEMBL_2286276
IC50
3.0±n/a nM
Citation
 Degorce, SLAagaard, AAnjum, RCumming, IADične, CRFallan, CJohnson, TLeuchowius, KJOrton, ALPearson, SRobb, GRRosen, AScarfe, GBScott, JSSmith, JMSteward, ORTerstiege, ITucker, MJTurner, PWilkinson, SDWrigley, GLXue, Y Improving metabolic stability and removing aldehyde oxidase liability in a 5-azaquinazoline series of IRAK4 inhibitors. Bioorg Med Chem 28:0 (2020) [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:
BDBM50612200
Synonyms:
CHEMBL5286869
Type:
Small organic molecule
Emp. Form.:
C22H26FN7O
Mol. Mass.:
423.4865
SMILES:
CN1CC2(CC(C2)n2cc(Nc3nc(OC4(C)CC4)c4nc(C)c(F)cc4n3)cn2)C1
Structure:
Search PDB for entries with ligand similarity: