TABLE 3.
Molecular docking results between ligands and core target receptors.
| Molecule name | Binding energy (kcal/mol) |
|---|---|
| Baclofen (GABBR1 agonist)PTGS2 | −7.0 |
| 3β-acetoxyatractylone | −5.3 |
| (+/−)-Isoborneol | −4.2 |
| α-Cubebol | −5.1 |
| Selina-4(14),7(11)-dien-8-one | −3.4 |
| (−)-Caryophyllene oxide | −6.3 |
| Juniper camphor | −4.8 |
| 2-[(2R,5S,6S)-6,10-dimethylspiro [4.5]dec-9-en-2-yl]propan-2-ol | −5.7 |
| Ermanthin | −5.8 |