BDBM50365790 CHEMBL1956569

InChI string: InChI=1S/C23H25N7O/c1-28(2)21-15-17(7-8-24-21)20-16-26-22(23-25-9-10-30(20)23)27-18-3-5-19(6-4-18)29-11-13-31-14-12-29/h3-10,15-16H,11-14H2,1-2H3,(H,26,27)

SMILES: CN(C)c1cc(ccn1)-c1cnc(Nc2ccc(cc2)N2CCOCC2)c2nccn12

InChI Key: InChIKey=FHVPVBVCPGYZIE-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 = 50365790   

Target (Institution)	Ligand	Target 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
MAP kinase-activated protein kinase 5 (Homo sapiens (human))	BDBM50365790 (CHEMBL1956569) Show SMILES CN(C)c1cc(ccn1)-c1cnc(Nc2ccc(cc2)N2CCOCC2)c2nccn12 Show InChI InChI=1S/C23H25N7O/c1-28(2)21-15-17(7-8-24-21)20-16-26-22(23-25-9-10-30(20)23)27-18-3-5-19(6-4-18)29-11-13-31-14-12-29/h3-10,15-16H,11-14H2,1-2H3,(H,26,27)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents AffyNet	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Galapagos NV Curated by ChEMBL					Assay Description Inhibition of MAPKAPK5				Bioorg Med Chem Lett 22: 2266-70 (2012)
					More data for this Ligand-Target Pair