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Target
3C-like protease
Ligand
BDBM47925
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
9811±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:
BDBM47925
Synonyms:
3-(4-amino-3,5-dichlorobenzoyl)-2-(3-amino-3-oxopropyl)-2H-indazole 1-oxide | 3-[3-(4-amino-3,5-dichloro-benzoyl)-1-oxido-indazol-1-ium-2-yl]propionamide | 3-[3-(4-amino-3,5-dichlorobenzoyl)-1-oxidoindazol-1-ium-2-yl]propanamide | 3-[3-[(4-amino-3,5-dichlorophenyl)-oxomethyl]-1-oxido-2-indazol-1-iumyl]propanamide | 3-[3-[4-azanyl-3,5-bis(chloranyl)phenyl]carbonyl-1-oxidanidyl-indazol-1-ium-2-yl]propanamide | MLS001097176 | SMR000718359 | cid_24817255
Type:
Small organic molecule
Emp. Form.:
C17H14Cl2N4O3
Mol. Mass.:
393.224
SMILES:
NC(=O)CCn1c(C(=O)c2cc(Cl)c(N)c(Cl)c2)c2ccccc2[n+]1[O-]
Structure:
Search PDB for entries with ligand similarity: