Table 1.
Compound data sets analyzed in this work.
| Data set | Unique compounds | Sources |
|---|---|---|
| Fungal metabolites | 223 | El-Elimat et al., 2012 |
| Natural products screening compounds (MEGx) | 2,500 | http://www.ac-discovery.com |
| Semi-synthetic screening compounds (NATx) | 2,500 | http://www.ac-discovery.com |
| Generally Recognized as Safe (GRAS) | 2,249 | Burdock et al., 2006; Medina-Franco et al., 2012 |
| Anticancer drugs from DrugBank | 76 | Wishart et al., 2006; Law et al., 2014 |
| Non-anticancer drugs from DrugBank | 1,399 | Wishart et al., 2006; Law et al., 2014 |