Target
Metallo-beta-lactamase type 2
Ligand
BDBM73278
Substrate
n/a
Meas. Tech.
ChEMBL_1567885 (CHEMBL3789280)
IC50
3109000±n/a nM
Citation
 Christopeit, TLeiros, HK Fragment-based discovery of inhibitor scaffolds targeting the metallo-ß-lactamases NDM-1 and VIM-2. Bioorg Med Chem Lett 26:1973-7 (2016) [PubMed]  Article 
Target
Name:
Metallo-beta-lactamase type 2
Synonyms:
B2 metallo-beta-lactamase | BLAN1_KLEPN | Beta-lactamase NDM-1 | Beta-lactamase type II | Metallo-beta-lactamase NDM-1 | Metallo-beta-lactamase type 2 | Metallo-beta-lactamase type II | NDM-1 | New Delhi metallo-beta-lactamase-1 | blaNDM-1
Type:
PROTEIN
Mol. Mass.:
28498.15
Organism:
Klebsiella pneumoniae
Description:
ChEMBL_103887
Residue:
270
Sequence:
MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR
  
Inhibitor
Name:
BDBM73278
Synonyms:
4-keto-4-(4-propylphenyl)butyric acid | 4-oxidanylidene-4-(4-propylphenyl)butanoic acid | 4-oxo-4-(4-propylphenyl)butanoic acid | MLS000098355 | SMR000062594 | cid_725542
Type:
Small organic molecule
Emp. Form.:
C13H16O3
Mol. Mass.:
220.2643
SMILES:
CCCc1ccc(cc1)C(=O)CCC(O)=O
Structure:
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