BDBM50104646 6-Benzyl-3-isopropyl-1H-pyrazin-2-one::CHEMBL419498

SMILES: CC(C)c1ncc(Cc2ccccc2)[nH]c1=O

InChI Key: InChIKey=CZUORGWXUVRUMV-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 = 50104646   

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
Calpain1 (Homo sapiens (Human))	BDBM50104646 (6-Benzyl-3-isopropyl-1H-pyrazin-2-one | CHEMBL4194...) Show SMILES CC(C)c1ncc(Cc2ccccc2)[nH]c1=O Show InChI InChI=1S/C14H16N2O/c1-10(2)13-14(17)16-12(9-15-13)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Compound was tested for its inhibitory activity against calpain isolated from Streptomyces species				Bioorg Med Chem Lett 11: 2647-9 (2001) BindingDB Entry DOI: 10.7270/Q28K78CV
					More data for this Ligand-Target Pair