Reaction Details Report a problem with these data
Target
3C-like protease
Ligand
BDBM47876
Substrate
n/a
Meas. Tech.
QFRET-based dose response biochemical high throughput screening assay to identify inhibitors of the SARS coronavirus 3C-like Protease (3CLPro)
IC50
9945±n/a nM
Citation
 PubChem, PC QFRET-based dose response biochemical high throughput screening assay to identify inhibitors of the SARS coronavirus 3C-like Protease (3CLPro) PubChem Bioassay (2009)[AID] 
Target
Name:
3C-like protease
Synonyms:
n/a
Type:
Enzyme Catalytic Domain
Mol. Mass.:
33462.05
Organism:
Avian infectious bronchitis virus
Description:
gi_73745819
Residue:
307
Sequence:
SGFKKLVSPSSAVEKCIVSVSYRGNNLNGLWLGDSIYCPRHVLGKFSGDQWGDVLNLANNHEFEVVTQNGVTLNVVSRRLKGAVLILQTAVANAETPKYKFVKANCGDSFTIACSYGGTVIGLYPVTMRSNGTIRASFLAGACGSVGFNIEKGVVNFFYMHHLELPNALHTGTDLMGEFYGGYVDEEVAQRVPPDNLVTNNIVAWLYAAIISVKESSFSQPKWLESTTVSIEDYNRWASDNGFTPFSTSTAITKLSAITGVDVCKLLRTIMVKSAQWGSDPILGQYNFEDELTPESVFNQVGGVRLQ
  
Inhibitor
Name:
BDBM47876
Synonyms:
4-(4-phenylpiperazin-1-yl)carbonyl-1H-quinolin-2-one | 4-(4-phenylpiperazine-1-carbonyl)-1H-quinolin-2-one | 4-(4-phenylpiperazine-1-carbonyl)carbostyril | 4-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-quinolin-2-one | CVD-0002709 | MAT-POS-916a2c5a-4 | MLS001033759 | SMR000385687 | cid_2083510
Type:
Small organic molecule
Emp. Form.:
C20H19N3O2
Mol. Mass.:
333.3838
SMILES:
O=C(N1CCN(CC1)c1ccccc1)c1cc(=O)[nH]c2ccccc12
Structure:
Search PDB for entries with ligand similarity: