Table 1 Datasets used in the analysis
From: Are the physicochemical properties of antibacterial compounds really different from other drugs?
Description | Set label | Set size |
|---|---|---|
Antibacterial actives compounds active in at least one antibacterial assay | AA | 10,503 |
Antibacterial inactives, compounds with only inactive ChEMBL records | AI | 340 |
Biochemical actives, compounds active against at least one antibacterial protein | BA | 2470 |
Biochemical inactives, compounds with only inactive biochemical assay records | BI | 399 |
Compounds active in both antibacterial and biochemical assays | BAAA | 555 |
Compounds active in biochemical assays, but no reported antibacterial activity | BAAI | 1835 |
Marketed antibacterial drugs | MAD | 116 |
Marketed other (non-antibacterial) drugs | MOD | 1225 |