Table 2 The nine HTS datasets with their PubChem Summary Assay ID (SAID)
From: Consensus queries in ligand-based virtual screening experiments
Protein target class | SAID | # Actives | # Inactives |
|---|---|---|---|
GPCR | 435008 | 233 | 217,925 |
1798 | 187 | 61,646 | |
435034 | 362 | 61,394 | |
Ion channel | 1843 | 172 | 301,321 |
2258 | 213 | 302,192 | |
463087 | 703 | 100,172 | |
Transporter | 488997 | 252 | 302,054 |
Kinase inhibitor | 2689 | 172 | 319,620 |
Enzyme | 485290 | 281 | 341,084 |