BDBM50124319 CHEMBL434691::Sodium; 4-{3-[2-amino-3-cyano-6-(2-hydroxy-phenyl)-pyridin-4-yl]-phenylcarbamoyl}-4-hydroxy-butyrate

SMILES: Nc1nc(cc(-c2cccc(NC(=O)C(O)CCC([O-])=O)c2)c1C#N)-c1ccccc1O

InChI Key: InChIKey=XZRDWCFAUFRMAF-UHFFFAOYSA-M

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50124319   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50124319 (CHEMBL434691 | Sodium; 4-{3-[2-amino-3-cyano-6-(2-...) Show SMILES Nc1nc(cc(-c2cccc(NC(=O)C(O)CCC([O-])=O)c2)c1C#N)-c1ccccc1O Show InChI InChI=1S/C23H20N4O5/c24-12-17-16(11-18(27-22(17)25)15-6-1-2-7-19(15)28)13-4-3-5-14(10-13)26-23(32)20(29)8-9-21(30)31/h1-7,10-11,20,28-29H,8-9H2,(H2,25,27)(H,26,32)(H,30,31)/p-1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto 619-0216 Curated by ChEMBL					Assay Description In vitro inhibitory concentration required against recombinant human IkB kinase beta (IKK-beta)				Bioorg Med Chem Lett 13: 913-8 (2003) BindingDB Entry DOI: 10.7270/Q2TM7BP1
					More data for this Ligand-Target Pair