Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM303017'   

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))	BDBM303017 (US9598440, 159) Show SMILES Cc1cc(Nc2cc(N[C@@H]3C[C@@H]([C@@H](O)[C@H]3O)C(C)(C)O)c(cn2)-c2nc3ccccc3s2)cc(C)n1 |r| Show InChI InChI=1S/C27H31N5O3S/c1-14-9-16(10-15(2)29-14)30-23-12-20(31-21-11-18(27(3,4)35)24(33)25(21)34)17(13-28-23)26-32-19-7-5-6-8-22(19)36-26/h5-10,12-13,18,21,24-25,33-35H,11H2,1-4H3,(H2,28,29,30,31)/t18-,21+,24+,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
MERCK SHARP & DOHME CORP. US Patent					Assay Description Procedure: A 20 μl reaction mixture contains 10 mM TriHCl, pH 7.2, 0.5 nM GST tagged IRAK4 (SignalChem), 100 nM fluorescent peptide substrate (R...				US Patent US9598440 (2017) BindingDB Entry DOI: 10.7270/Q2XG9T6V
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