Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM188882'   

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))	BDBM188882 (US9169260, 148) Show SMILES O=C(Nc1cc(nn1-c1ccc(cn1)C1CC1)C1CCN(CC1)C1CCC1)c1cnn2cccnc12 Show InChI InChI=1S/C27H30N8O/c36-27(22-17-30-34-12-2-11-28-26(22)34)31-25-15-23(19-9-13-33(14-10-19)21-3-1-4-21)32-35(25)24-8-7-20(16-29-24)18-5-6-18/h2,7-8,11-12,15-19,21H,1,3-6,9-10,13-14H2,(H,31,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	7.2	n/a
MERCK SHARP & DOHME CORP. US Patent					Assay Description The kinase activity of IRAK-4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phos...				US Patent US9169260 (2015) BindingDB Entry DOI: 10.7270/Q26H4G6N
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