Instant JChem data


This page catalogues data that is available in Instant JChem format. Of course a wide range of file formats can eaily be imported into Instant JChem, but it is simpler to get started if data is already imported and forms already built. This is possible by providing an Instant JChem project as a zip file. Please contact support at chemaxon dot com if you have data that you would like to provide in Instant JChem format.

To load any of these data sets:

  • Download the zipped project
  • Unzip the project
  • Open the project in Instant JChem (File -> Open project)

Note: if the project version is older than your current version of IJC the database may need updating the first time you open it. If the database version is newer than your version of IJC it may not open correctly and you should upgrade IJC to the latest version.

Demo data sets

These are sample data sets of commercial databases. Contact the supplier if you would like to purchase the full product.

Eidogen KKB database

Description: SRC, ABL1 aned AURKA kinase activities for 3886 compounds. Full version contains >148,000 molecules and >394 kinase targets.
Supplier: Eidogen-Sertanty
More info: www.eidogen-sertanty.com/products_kinasekb.html
IJC database version: 2.5.3
Download: KKB-Demo.zip

IJC database version: 6.1
Download: KKB-Demo61.zip

Wombat database

Description: 5000 compounds from the Wombat database, containing activity data, predicted properties and literature references. Full version contains approximately 300,000 entries and 2,000 targets.
Supplier: Sunset Molecular
More info: www.sunsetmolecular.com/index.php?option=com_content&view=article&id=15&Itemid=10
IJC database version: 2.5.3
Notes: Not for commercial use
Download: wbdemo.zip

IJC database version: 6.1
Download: wbdemo61.zip



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