Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Inhibitor of nuclear factor kappa-B kinase subunit beta' and Ligand = 'BDBM26079'   

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
Inhibitor of nuclear factor kappa-B kinase subunit beta (Homo sapiens (Human))	BDBM26079 (2-(carbamoylamino)-5-{2-[5-(1-hydroxypropyl)thioph...) Show SMILES CCC(O)c1cc(cs1)C#Cc1cc(C(N)=O)c(NC(N)=O)s1 Show InChI InChI=1S/C15H15N3O3S2/c1-2-11(19)12-5-8(7-22-12)3-4-9-6-10(13(16)20)14(23-9)18-15(17)21/h5-7,11,19H,2H2,1H3,(H2,16,20)(H3,17,18,21)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	465	n/a	n/a	n/a	n/a	7.6	25
Pfizer					Assay Description The inhibitory effect of test compounds on kinase activity was measured using a biotinylated I-Kappa-B-alpha peptide and increasing doses of inhibito...				Bioorg Med Chem Lett 15: 2870-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.090 BindingDB Entry DOI: 10.7270/Q2T72FRG
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