Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM51943
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:
BDBM51943
Synonyms:
2-Methoxy-N-(5-{[(thiophen-2-ylmethyl)-carbamoyl]-methylsulfanyl}-[1,3,4]thiadiazol-2-yl)-acetamide | 2-methoxy-N-[5-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]ethanamide | 2-methoxy-N-[5-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide | 2-methoxy-N-[5-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]acetamide | MLS000033296 | N-[5-[[2-keto-2-(2-thenylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]-2-methoxy-acetamide | SMR000006626 | cid_655628
Type:
Small organic molecule
Emp. Form.:
C12H14N4O3S3
Mol. Mass.:
358.46
SMILES:
COCC(=O)Nc1nnc(SCC(=O)NCc2cccs2)s1
Structure:
Search PDB for entries with ligand similarity: