yarmoluk
Joined: 27 Feb 2008
Posts: 22
Location: Ukraine
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 Posted: Thu Mar 06, 2008 2:25 pm Post subject: Phospholipase A(2) (PLA(2)) inhibitors |
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Otava presents a new Phospholipase A(2) (PLA(2)) focused library with 834 compounds.
This library has been created as a part of a project aimed at design of a large set of receptor-based sharp-focused libraries. In the framework of this project Otava In-house Stock Collection (100 000 compounds) was used for library preparation.
Design of the focused libraries consists in Lipinsky/Veber rules filtering and flexible docking in a protein target of certain enzyme family. Further computational analysis for the presence of critical receptor-ligand hydrogen bond(s) and docking score refinement makes our focused libraries good starting point for drug discovery purposes.
The detection of H-bonding between ligand and key PLA(2) residues (Gly29, His47) was used for the library preparation.
About Otava
Otava supplies Receptor Based and Target Focused compound libraries, custom synthesis, fine chemicals, ProHit compounds, protein kinase inhibitors, combinatorial chemistry templates and building blocks, fluorescent cyanine dyes, Noteworthy Compounds. They offer design and development of fluorescent probes, kits and reagents.
Company contact information:
OTAVA
P.O. Box 88
Kyiv 187, 03187
Ukraine
E-mails:
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