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 = 'BDBM50506700'   

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))	BDBM50506700 (CHEMBL4439395) Show SMILES O=C(Cc1ccc(cc1)-c1ccccc1)Nc1cc([nH]n1)C1CCC1 Show InChI InChI=1S/C21H21N3O/c25-21(22-20-14-19(23-24-20)18-7-4-8-18)13-15-9-11-17(12-10-15)16-5-2-1-3-6-16/h1-3,5-6,9-12,14,18H,4,7-8,13H2,(H2,22,23,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Eppley Institute for Research in Cancer and Allied Diseases Curated by ChEMBL					Assay Description Inhibition of IKKbeta (unknown origin)				Bioorg Med Chem Lett 28: 3736-3740 (2018) Article DOI: 10.1016/j.bmcl.2018.10.020 BindingDB Entry DOI: 10.7270/Q26M3B39
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