ChemNavigator Newsletter - March 2005

Visit us in Booth 117 at the ACS Conference in San Diego!
ChemNavigator is a proud participant in the upcoming American Chemical Society National Exhibition at the San Diego Convention Center. Visit us in the exhibition hall March 14th through 16th.


New Cheminformatics Software Applications Released
ChemNavigator is pleased to announce the availability of new chemical structure management and analysis software tools.

For chemical structure database management and analysis:
CncTranslate - Cheminformatics Utility Program
CncTranslate is a central component of ChemNavigator's software tool kit for cheminformatics data management and analysis.
CncMCS - Maximum Common Substructure Analysis
CncMCS is designed to rapidly identify the maximum common chemical substructure, or common core, contained within a series of chemical structures.
CncDiverse - Diverse Library Selection
CncDiverse is a software tool for the selection of diverse chemical libraries from within a database of chemical structures. CncDiverse uses fragment based molecular fingerprints to make similarity comparisons between a single molecule and all others in a database.
For 3D Chemical Searching and Docking:
3DPL™ - Fast, Exhaustive, Flexible 3D Virtual Screening
3 dimensional protein-ligand search (3DPL) is now available as a software package. 3DPL offers a rapid approach for selecting a population of targeted small molecules from starting sets of millions that are likely to bind to a protein surface.
Click here to visit our web site and download ChemNavigator's software products for a free evaluation.



ChemNavigator Joins SciTegic ISV Program for Pipeline Pilot™ Integration
We have signed a new Independent Software Vendor Partnership with San Diego-based SciTegic. Under this program, ChemNavigator's new cheminformatics software applications will be supported under the popular Pipeline Pilot data piping architecture. The first products to be released will be the new CncTranslate Cheminformatics Utility Program and the 3DPL™ Flexible 3D Virtual Screening Program. Stop by Booth 117 at the ACS Exhibit to learn about how our software will integrate with Pipeline Pilot.



iResearch Library Tracks Dramatic Change in Screening Compound Inventories
The ChemNavigator iResearch Library continues to track major inventory changes in the screening compound market. Currently, the iResearch Library includes over 145 Supplier Partners. On average, each quarter:
  • Approximately 100 data updates are processed
  • 1.5 - 4.0 million new offerings are added
  • 2.0 - 8.0 million existing offerings are reconfirmed
  • 0.5 - 2.5 million offerings are inactivated

Supplier News
ChemNavigator added 5 new chemistry suppliers as well as new supplier collections to the iResearch Library database during Q4 2004. Among these ChemNavigator welcomes AnalytiCon Discovery as a supplier and the addition of Princeton BioMolecular Research's new building block collection:

  • AnalytiCon Discovery is a German biotechnology company focusing on the development of compound libraries consisting of synthetic and natural product small molecules. AnalytiCon Discovery stands for attractive, innovative synthetic chemistry, leading - usually within 4 to 8 synthetic steps - to small, chiral, 3-dimensional, highly diverse, nitrogen rich molecules (NatDiverse NATx). Furthermore AnalytiCon offers pure natural product (NP) small molecules complete with structures that have been fully elucidated by NMR (MEGAbolite MEGx). As a pure compound provider the company is offering its products and services to the pharmaceutical, chemical, biotech, cosmetic and nutraceutical industries. AnalytiCon Discovery's customers from all over the world are using the compounds to develop new drugs, crop protection agents, cosmetics and food additives. Besides this offer AnalytiCon has medicinal chemistry and computational chemistry in place and can act as a one stop shop for early drug development based on - but not limited to - natural products.
    Click here to learn more about AnalytiCon

  • Princeton BioMolecular Research has released a new collection of novel building blocks containing amines, protected amino acids, carboxylic acids, acid halides, mono-protected diamines, aldehydes, phenols as well as unique heterocyclic compounds and common pharmacophores. Click here for more information.

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ChemNavigator develops and markets scientific software and database technology. Our products and services help pharmaceutical, biotech research and crop protection companies cost effectively discover new biologically active compounds.
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