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DSSTox

Distributed Structure-Searchable Toxicity (DSSTox) Database Network is a project of EPA's National Center for Computational Toxicology, helping to build a public data foundation for improved structure-activity and predictive toxicology capabilities. The DSSTox website provides a public forum for publishing downloadable, structure-searchable, standardized chemical structure files associated with toxicity data. More>

Graphic linking to EPA DSSTox Structure-Browser v1.0v 2.0

DSSTox Structure-Browser information Page

 

bar27 March 2009bar

bullet ARYEXP: European Bioinformatics Institute (EBI) ArrayExpress Repository for Gene Expression Experiments **Updated to v2a
Corresponds to updated content of EBI ArrayExpress website as of 20 January 2009.

bullet GEOGSE: National Center for Biotechnology Information (NCBI) Gene Expression Omnibus (GEO) Series Experiments **Updated to v2a
Corresponds to updated content of NCBI GEO website as of 02 February 2009.

bullet NTPHTS: National Toxicology Program High-Throughput Screening Structure-Index File **Updated to v2c
Minor modifications to 9 structures based on additional review.

bar19 February 2009bar

bullet KIERBL: EPA Estrogen Receptor Ki Binding Study (Laws et al.) Database File ** New File
Includes experimental Estrogen Receptor (ER) binding IC50 and Ki results for 50 chemicals (17 binders) included in the Main Citation (Laws et al., 2006) and previously unpublished results for 228 structurally diverse environmental chemicals for which no ER binding was observed in initial screening studies
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bullet ARYEXP: European Bioinformatics Institute (EBI) ArrayExpress Repository for Gene Expression Experiments **Updated to v2a
Corresponds to updated content of EBI ArrayExpress website as of 20 January 2009.

bullet GEOGSE: National Center for Biotechnology Information (NCBI) Gene Expression Omnibus (GEO) Series Experiments **Updated to v2a
Corresponds to updated content of NCBI GEO website as of 02 February 2009.

bar12 February 2009bar

TOXCST: Research Chemical Inventory for EPA's ToxCast Program ** Updated to v3a
Minor QC corrections and new fields for identifying replicates and parent0-metabolite pairs.

**Announcement: The DSSTox TOXCST Structure-Index File will accompany high-throughput screening and in vivo bioassay data being made available for this chemical inventory to participants of the first ToxCast™ Data Analysis Summit hosted by EPA's National Center for Computational Toxicology.

bullet NTPBSI: National Toxicology Program Bioassay On-line Database Structure-Index Locator File ** Updated to v4b
Corresponds to updated content of NTP website as of 13 January 2009.

STRUCTURE_InChI and STRUCTURE_InChIKey field entries in newly published or updated files will conform to newly released InChI 1.02 Standards exit EPA.

 

For complete listing of past DSSTox postings, see Recent Additions & History

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Graphic of Structures+Toxicity Data feeding into DSSTox SDF Files
DSSTox Graphic Flowchart
DSSTox Project Goals
DSSTox Publications

=DSSTox Data Files: Details>

=ARYEXP_v2a_958_06Mar2009 ** Updated
=CPDBAS_v5d_1547_20Nov2008

=DBPCAN_v4b_209_15Feb2008
=EPAFHM_v4b_617_15Feb2008
=FDAMDD_v3b_1216_15Feb2008

=GEOGSE_v2a_1179_09Mar2009 ** Updated
=HPVCSI_v2c_3548_15Feb2008
=HPVISD_v1b_1006_15Feb2008

=IRISTR_v1b_544_15Feb2008
=KIERBL_v1a_278_17Feb2009 ** New
=NCTRER_v4b_232_15Feb2008

=NTPBSI_v4b_2315_26Jan2009 ** Updated
=NTPHTS_v2c_1408_11Mar2009 ** Updated
=TOXCST_v3a_320_12Feb2009 ** Updated

>External Data Files (ISSCAN)

Quick & Easy File Downloads:

FTP Download Instruction

DSSTox Information Pages:
Structure-Browser Information
Master File Information
Chemical Information Quality Review Procedures

Standard Chemical Fields
Publications
Presentations
Searching DSSTox Files in PubChem
More>


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