BDBM50508002 CHEMBL4563747

SMILES: COc1cc2ncnc(C3CCN(CC3)C(=O)c3ccc(F)cc3)c2cc1OC

InChI Key: InChIKey=YQVYGDDPHIKTFP-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 = 50508002   

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
Extracellular signal-regulated kinase 5 (ERK5) (Homo sapiens (Human))	BDBM50508002 (CHEMBL4563747) Show SMILES COc1cc2ncnc(C3CCN(CC3)C(=O)c3ccc(F)cc3)c2cc1OC Show InChI InChI=1S/C22H22FN3O3/c1-28-19-11-17-18(12-20(19)29-2)24-13-25-21(17)14-7-9-26(10-8-14)22(27)15-3-5-16(23)6-4-15/h3-6,11-14H,7-10H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bayer AG Curated by ChEMBL					Assay Description Inhibition of His-tagged MAP2K5 activated N-terminal GST-tagged recombinant human ERK5 (1 to 398 residues) expressed in Escherichia coli using biotin...				J Med Chem 62: 928-940 (2019) Article DOI: 10.1021/acs.jmedchem.8b01606
					More data for this Ligand-Target Pair