BDBM50302207 3-amino-4-isobutyl-6-methylthieno[2,3-b]pyridine-2-carboxamide::CHEMBL572002

SMILES: CC(C)Cc1cc(C)nc2sc(C(N)=O)c(N)c12

InChI Key: InChIKey=OKACLCKEXNYVOK-UHFFFAOYSA-N

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 = 50302207   

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))	BDBM50302207 (3-amino-4-isobutyl-6-methylthieno[2,3-b]pyridine-2...) Show SMILES CC(C)Cc1cc(C)nc2sc(C(N)=O)c(N)c12 Show InChI InChI=1S/C13H17N3OS/c1-6(2)4-8-5-7(3)16-13-9(8)10(14)11(18-13)12(15)17/h5-6H,4,14H2,1-3H3,(H2,15,17)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay				Bioorg Med Chem Lett 19: 5547-51 (2009) Article DOI: 10.1016/j.bmcl.2009.08.054 BindingDB Entry DOI: 10.7270/Q22Z16G1
					More data for this Ligand-Target Pair