Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM50095464'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM50095464 (CHEMBL3590437 | US9649308, Example 39) Show SMILES Cn1cc(NC(=O)c2cnn3ccc(OCCN)nc23)c(n1)C(N)=O Show InChI InChI=1S/C14H16N8O3/c1-21-7-9(11(20-21)12(16)23)18-14(24)8-6-17-22-4-2-10(19-13(8)22)25-5-3-15/h2,4,6-7H,3,5,15H2,1H3,(H2,16,23)(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The kinase activity of IRAK4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phosp...				US Patent US10155765 (2018) BindingDB Entry DOI: 10.7270/Q21V5H2J
					More data for this Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM50095464 (CHEMBL3590437 | US9649308, Example 39) Show SMILES Cn1cc(NC(=O)c2cnn3ccc(OCCN)nc23)c(n1)C(N)=O Show InChI InChI=1S/C14H16N8O3/c1-21-7-9(11(20-21)12(16)23)18-14(24)8-6-17-22-4-2-10(19-13(8)22)25-5-3-15/h2,4,6-7H,3,5,15H2,1H3,(H2,16,23)(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck& Co. Curated by ChEMBL					Assay Description Inhibition of human IRAK4 assessed as phosphorylation of fluorescent peptide substrate after 30 mins by fluorescent polarization reader				ACS Med Chem Lett 6: 683-8 (2015) Article DOI: 10.1021/acsmedchemlett.5b00107 BindingDB Entry DOI: 10.7270/Q2QF8VNH
					More data for this Ligand-Target Pair