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Target
Beta-lactamase
Ligand
BDBM52002
Substrate
n/a
Meas. Tech.
FRET-based counterscreen for selective VIM-2 inhibitors: dose response biochemical high throughput screening assay to identify inhibitors of IMP-1 metallo-beta-lactamase.
IC50
59640±n/a nM
Citation
 PubChem, PC FRET-based counterscreen for selective VIM-2 inhibitors: dose response biochemical high throughput screening assay to identify inhibitors of IMP-1 metallo-beta-lactamase. PubChem Bioassay (2009)[AID] 
Target
Name:
Beta-lactamase
Synonyms:
Beta-lactamase | metallo-beta-lactamase IMP-1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
27125.88
Organism:
Pseudomonas aeruginosa
Description:
gi_27368096
Residue:
246
Sequence:
MSKLSVFFIFLFCSIATAAESLPDLKIEKLDEGVYVHTSFEEVNGWGVVPKHGLVVLVNAEAYLIDTPFTAKDTEKLVTWFVERGYKIKGSISSHFHSDSTGGIEWLNSRSIPTYASELTNELLKKDGKVQATNSFSGVNYWLVKNKIEVFYPGPGHTPDNVVVWLPERKILFGGCFIKPYGLGNLGDANIEAWPKSAKLLKSKYGKAKLVVPSHSEVGDASLLKLTLEQAVKGLNESKKPSKPSN
  
Inhibitor
Name:
BDBM52002
Synonyms:
4-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-5-quinolin-2-yl-4H-[1,2,4]triazole-3-thiol | 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-quinolinyl)-1H-1,2,4-triazole-5-thione | 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-quinolyl)-1H-1,2,4-triazole-5-thione | 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione | MLS000333039 | SMR000436396 | cid_3729854
Type:
Small organic molecule
Emp. Form.:
C19H14N4O2S
Mol. Mass.:
362.405
SMILES:
S=c1[nH]nc(-c2ccc3ccccc3n2)n1-c1ccc2OCCOc2c1
Structure:
Search PDB for entries with ligand similarity: