BDBM50508008 CHEMBL4438379

SMILES: FC(F)(F)Oc1ccc(cc1)C(=O)N1CCC(CC1)c1ncnc2cc(cnc12)N1CCOCC1

InChI Key: InChIKey=KDKCALNNEHIURA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50508008   

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))	BDBM50508008 (CHEMBL4438379) Show SMILES FC(F)(F)Oc1ccc(cc1)C(=O)N1CCC(CC1)c1ncnc2cc(cnc12)N1CCOCC1 Show InChI InChI=1S/C24H24F3N5O3/c25-24(26,27)35-19-3-1-17(2-4-19)23(33)32-7-5-16(6-8-32)21-22-20(29-15-30-21)13-18(14-28-22)31-9-11-34-12-10-31/h1-4,13-16H,5-12H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Bayer AG Curated by ChEMBL					Assay Description Inhibition of ERK5 in human SN12C cells transduced with MEF2-responsive transcription element assessed as reduction in MEF2 transcription by measurin...				J Med Chem 62: 928-940 (2019) Article DOI: 10.1021/acs.jmedchem.8b01606
					More data for this Ligand-Target Pair
Extracellular signal-regulated kinase 5 (ERK5) (Homo sapiens (Human))	BDBM50508008 (CHEMBL4438379) Show SMILES FC(F)(F)Oc1ccc(cc1)C(=O)N1CCC(CC1)c1ncnc2cc(cnc12)N1CCOCC1 Show InChI InChI=1S/C24H24F3N5O3/c25-24(26,27)35-19-3-1-17(2-4-19)23(33)32-7-5-16(6-8-32)21-22-20(29-15-30-21)13-18(14-28-22)31-9-11-34-12-10-31/h1-4,13-16H,5-12H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	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