Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM63710
Substrate
n/a
Meas. Tech.
ChEMBL_839906 (CHEMBL2090107)
IC50
>200000±n/a nM
Citation
Chen, P; Horton, LB; Mikulski, RL; Deng, L; Sundriyal, S; Palzkill, T; Song, Y 2-Substituted 4,5-dihydrothiazole-4-carboxylic acids are novel inhibitors of metallo-ß-lactamases. Bioorg Med Chem Lett 22:6229-32 (2012) [PubMed] Article
More Info.:
Target
Name:
Beta-lactamase
Synonyms:
BAS3245 | Beta-lactamase (Bla2) | Beta-lactamase II | GBAA_3500 | bla2
Type:
Enzyme
Mol. Mass.:
28177.23
Organism:
Bacillus anthracis
Description:
Q93T40
Residue:
256
Sequence:
MKNTLLKLGVCVSLLGITPFVSTISSVQAERKVEHKVIKNETGTISISQLNKNVWVHTELGYFNGEAVPSNGLILNTSKGLVLVDSSWDDKLTKELIEMAEKKFKKSVTDVIITHAHADRIGGIKTLKERGIKAHSTTLTAELAKKNGYEEPLGDLQAITKLKFGNMKVETFYPGKGHTEDNIVVWLPQYNMLVGGCLVKSASAKDLGNITDAYVNEWSTSIENVLKRYENINFVVPGHGEVGDKGLLLHTLDLLK
Inhibitor
Name:
BDBM63710
Synonyms:
2-phenyl-1,3-thiazole-4-carboxylic acid | 2-phenyl-4-thiazolecarboxylic acid | 2-phenylthiazole-4-carboxylic acid | MLS000773831 | SMR000364704 | cid_138928
Type:
Small organic molecule
Emp. Form.:
C10H7NO2S
Mol. Mass.:
205.233
SMILES:
OC(=O)c1csc(n1)-c1ccccc1