BDBM50358603 CHEMBL1923994

SMILES: CNc1nc2[nH]c(cc2c2n(C)cnc12)-c1cc(CNC(C)=O)ccn1

InChI Key: InChIKey=LREWJGGYTDMQIN-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 = 50358603   

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))	BDBM50358603 (CHEMBL1923994) Show SMILES CNc1nc2[nH]c(cc2c2n(C)cnc12)-c1cc(CNC(C)=O)ccn1 Show InChI InChI=1S/C18H19N7O/c1-10(26)21-8-11-4-5-20-13(6-11)14-7-12-16-15(22-9-25(16)3)18(19-2)24-17(12)23-14/h4-7,9H,8H2,1-3H3,(H,21,26)(H2,19,23,24)	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	330	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human IKK2-mediated GST-IkappaBalpha protein fusion phosphorylation				Bioorg Med Chem Lett 21: 7006-12 (2011) Article DOI: 10.1016/j.bmcl.2011.09.111 BindingDB Entry DOI: 10.7270/Q2Z038KC
					More data for this Ligand-Target Pair