BDBM50422605 CHEMBL407960

SMILES: COc1ccc(OC)c(CNc2[nH]nc3ccnc(Oc4ccccc4)c23)c1

InChI Key: InChIKey=XWQFWBSOLVEUDU-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 = 50422605   

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
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM50422605 (CHEMBL407960) Show SMILES COc1ccc(OC)c(CNc2[nH]nc3ccnc(Oc4ccccc4)c23)c1 Show InChI InChI=1S/C21H20N4O3/c1-26-16-8-9-18(27-2)14(12-16)13-23-20-19-17(24-25-20)10-11-22-21(19)28-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H2,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Negative log of inhibitiory concentration determined against c-Jun N-terminal kinase (Activity reported against the isolated JNK-1 enzyme)				Bioorg Med Chem Lett 15: 3459-62 (2005) Article DOI: 10.1016/j.bmcl.2005.05.008 BindingDB Entry DOI: 10.7270/Q2QC04SW
					More data for this Ligand-Target Pair