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Novel diphenyl ethers: design, docking studies, synthesis and inhibition of enoyl ACP reductase of Plasmodium falciparum and Escherichia coli.
- Source :
-
Bioorganic & medicinal chemistry [Bioorg Med Chem] 2006 Dec 01; Vol. 14 (23), pp. 8086-98. Date of Electronic Publication: 2006 Aug 08. - Publication Year :
- 2006
-
Abstract
- We designed some novel diphenyl ethers and determined their binding energies for Enoyl-Acyl Carrier Protein Reductase (ENR) of Plasmodium falciparum using Autodock. Out of these, we synthesized the promising compounds and tested them for their inhibitory activity against ENRs of P. falciparum as well as Escherichia coli. Some of these compounds show nanomolar inhibition of PfENR and low micromolar inhibition of EcENR. They also exhibit low micromolar potency against in vitro cultures of P. falciparum and E. coli. The study of structure-activity relationship of these compounds paves the way for further improvements in the design of novel diphenyl ethers with improved activity against purified enzyme and the pathogens.
- Subjects :
- Animals
Anti-Bacterial Agents pharmacology
Antiprotozoal Agents pharmacology
Computer Simulation
Drug Design
Escherichia coli enzymology
Phenyl Ethers chemical synthesis
Plasmodium falciparum enzymology
Protein Binding
Structure-Activity Relationship
Anti-Bacterial Agents chemical synthesis
Antiprotozoal Agents chemical synthesis
Enoyl-(Acyl-Carrier-Protein) Reductase (NADH) antagonists & inhibitors
Escherichia coli Proteins antagonists & inhibitors
Phenyl Ethers pharmacology
Protozoan Proteins antagonists & inhibitors
Subjects
Details
- Language :
- English
- ISSN :
- 0968-0896
- Volume :
- 14
- Issue :
- 23
- Database :
- MEDLINE
- Journal :
- Bioorganic & medicinal chemistry
- Publication Type :
- Academic Journal
- Accession number :
- 16893651
- Full Text :
- https://doi.org/10.1016/j.bmc.2006.07.034