Database Statistics

Overall statistics

Metric	T3DB 1.0	T3DB 2.0	SynCED
Total Number of Contaminants	2,896	3,679	316,418
Total Number of Clean Air Act Chemicals	0^a	0^a	1,041
Total Number of Cosmetic Chemicals	0^a	0^a	324
Total Number of DEA Chemicals	0^a	0^a	48
Total Number of Disinfection Byproducts	0^a	0^a	136
Total Number of DrugBank Drugs	0^a	0^a	13,970
Total Number of EAFUS Chemicals	0^a	0^a	2,285
Total Number of ECHA Carcinogen	0^a	0^a	8
Total Number of ECHA Mutagen	0^a	0^a	0
Total Number of ECHA PBT	0^a	0^a	1
Total Number of ECHA Toxic for reproduction	0^a	0^a	20
Total Number of ECHA vPvB	0^a	0^a	1
Total Number of EPA Endocrine Screening	0^a	0^a	57
Total Number of FooDB Chemicals	0^a	0^a	6,073
Total Number of HMDB Contaminants - Feces	0^a	0^a	532
Total Number of HMDB Contaminants - Urine	0^a	0^a	2,390
Total Number of HPV EPA Chemicals	0^a	0^a	4,775
Total Number of IARC Carcinogens	0^a	0^a	1,238
Total Number of My Exposome Chemicals	0^a	0^a	1,025
Total Number of OECD HPV Chemicals	0^a	0^a	980
Total Number of OSHA Hazardous Chemicals	0^a	0^a	104
Total Number of Sludge Chemicals	0^a	0^a	259
Total Number of STOFF IDENT Compounds	0^a	0^a	8,132
Total Number of Suspected Compounds	0^a	0^a	210
Total Number of Suspected Compounds - Waste Water	0^a	0^a	175
Total Number of Suspected Compounds – Schymanski Project	0^a	0^a	152
Total Number of Tobacco Smoke Compounds	0^a	0^a	123
Total Number of ToxCast & Tox21 Chemicals	0^a	0^a	6,715
Total Number of Unique Targets	1,215	2,084	5,298
Total Number of Upregulated/Downregulated Genes	0	15,842	15,190
Total Number of Synonyms	32,276	42,422	295,003
Total Number of References	2,937	18,058	18,144
Total Number of Pathways	0	384	413
Total Number of External Database Links	12	15	18
Number of Data Fields per Compound Card	80	97	109
Number of Search Types	4	9	7
Number of Physchem Parameters per Compound	8	23	25

Compound Statistics

Metric	T3DB 1.0	T3DB 2.0	SynCED
Total Number of Compounds with Chemical Taxonomic Data	0	3,679	200,324
Total Number of Compounds with Ontological Data	0	887	6,823
Percentage of Compounds with Descriptions	99.6%	100.0%	0.9%
Percentage of Compounds with Structures	93.4%	100.0%	100.0%
Percentage of Compounds with Targets	90.5%	95.8%	3.1%
Total Number of Compounds with Mechanism of Toxicity	2,895	3,256	2,367
Total Number of Compounds with LD50 Data	393	1,170	262
Total Number of Compounds with Normal Concentrations	0	889	93
Total Number of Compounds with Metabolism Data	2,494	2,907	2,078
Total Number of Compounds with Symptoms	2,714	2,868	2,037
Total Number of Compounds with Treatment	1,761	2,337	1,623
Total Number of Compounds with Target Binding Constant Data	0	1,003	927
Total Number of Compounds with Spectra	0^a	0^a	0
Total Number of Compounds with NMR Spectra	0	746	0
Total Number of Compounds with MS Spectra	0	1,170	0
Total Number of Compounds with 1D NMR Spectra	0^a	0^a	0
Total Number of Compounds with 2D NMR Spectra	0^a	0^a	0
Total NMR Spectra	0^a	0^a	0
Total MS Spectra	0^a	0^a	0
Total Predicted MS/MS Spectra	0^a	0^a	1,709,112
Total Experimental MS/MS Spectra	0^a	0^a	0
Total Number of Spectra	0^a	0^a	0

T3DB 1.0 and T3DB 2.0 values are from Table 1 of Wishart et al. (2015).
^a New category in SynCED; not reported for T3DB 1.0 or 2.0.

Database Statistics

Overall statistics

Compound Statistics

Structure