Table 3.
(a) Compound | Recon: Compound | Hreed: SmallMolecule |
---|---|---|
All | 5063 | 74 286 |
Unique/non-compartment | 2626 | 74 286 |
With InChI | 1332 | 74 286 |
With standard InChI | 974 | 74 286 |
(b) Reaction | Recon: Reaction | Hreed: Reaction |
All | 7440 | 2250 |
Unique/non-compartment | 4910 | 2250 |
Metabolic reaction | 3309 | 2250 |
Transport reaction | 1601 | 0 |
(c) Reaction based on gene association | Recon: Reaction | Hreed: Reaction |
All | 4252 | 1162 |
Unique/non-compartment | 2875 | 1162 |
Unique metabolic reaction | 2484 | 1162 |
Transport reaction | 391 | 0 |