Compile Data Set for Download or QSAR
Found 3 Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM294303'
TargetInterleukin-1 receptor-associated kinase 4(Homo sapiens (Human))
Merck Sharp & Dohme Corp

US Patent
LigandPNGBDBM294303(US9586948, Example 22)
Show SMILES Cn1cc(NC(=O)c2cccc(n2)-c2ccsc2)c(n1)C(N)=O
Show InChI InChI=1S/C15H13N5O2S/c1-20-7-12(13(19-20)14(16)21)18-15(22)11-4-2-3-10(17-11)9-5-6-23-8-9/h2-8H,1H3,(H2,16,21)(H,18,22)
Affinity DataIC50: 362nMpH: 7.2Assay Description:The kinase activity of IRAK4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phosp...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetInterleukin-1 receptor-associated kinase 4(Homo sapiens (Human))
Merck Sharp & Dohme Corp

US Patent
LigandPNGBDBM294303(US9586948, Example 22)
Show SMILES Cn1cc(NC(=O)c2cccc(n2)-c2ccsc2)c(n1)C(N)=O
Show InChI InChI=1S/C15H13N5O2S/c1-20-7-12(13(19-20)14(16)21)18-15(22)11-4-2-3-10(17-11)9-5-6-23-8-9/h2-8H,1H3,(H2,16,21)(H,18,22)
Affinity DataIC50: 401nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged full-length IRAK4 expressed in baculovirus infected Sf9 insect cells using 5FAM-RKRQGSVRRRVH-CO...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetInterleukin-1 receptor-associated kinase 4(Homo sapiens (Human))
Merck Sharp & Dohme Corp

US Patent
LigandPNGBDBM294303(US9586948, Example 22)
Show SMILES Cn1cc(NC(=O)c2cccc(n2)-c2ccsc2)c(n1)C(N)=O
Show InChI InChI=1S/C15H13N5O2S/c1-20-7-12(13(19-20)14(16)21)18-15(22)11-4-2-3-10(17-11)9-5-6-23-8-9/h2-8H,1H3,(H2,16,21)(H,18,22)
Affinity DataIC50: 401nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged full-length IRAK4 expressed in baculovirus infected Sf9 insect cells using 5FAM-RKRQGSVRRRVH-CO...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid