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ChemBank: a small-molecule screening and cheminformatics resource database.

Kathleen Petri Seiler1, Gregory A George, Mary Pat Happ

  • 1Chemical Biology Program and Platform, Broad Institute of Harvard and MIT, 7 Cambridge Center, Cambridge, MA 02142, USA.

Nucleic Acids Research
|October 20, 2007
PubMed
Summary
This summary is machine-generated.

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ChemBank is a public informatics environment providing freely available small molecule screening data and analysis tools. It aims to give life scientists access to valuable data previously limited to the private sector.

Area of Science:

  • Chemical Biology
  • Bioinformatics
  • Drug Discovery

Background:

  • Small molecule screening generates vast amounts of data.
  • Access to this data is often limited to the private sector.
  • Existing databases lack comprehensive raw screening data storage and rigorous experimental definitions.

Purpose of the Study:

  • To establish a public, web-based informatics environment for small molecule screening data.
  • To provide freely available data and resources for studying small molecules and their effects.
  • To enable life scientists to access and analyze previously private data.

Main Methods:

  • Development of a public, web-based informatics environment (ChemBank).
  • Storage of raw screening data with rigorous statistical hypothesis testing.

Related Experiment Videos

  • Metadata-based organization of screening experiments into projects and related assays.
  • Integration of analysis tools for studying relationships between small molecules and biological measurements.
  • Main Results:

    • ChemBank provides access to hundreds of thousands of small molecules and hundreds of assays.
    • The platform stores diverse measurements from cell-based assays treated with small molecules.
    • Analysis tools are continuously developed to study small molecule-cell measurement relationships.

    Conclusions:

    • ChemBank offers a unique resource for small molecule research.
    • The platform democratizes access to valuable screening data and analysis tools.
    • It facilitates research by providing unfettered access to previously private sector data.