Table 2.
Docking results performing binding energy of ligands from Ageratum conyzoides interacting with seven proteins playing a role in diverse pathologic condition.
| Ligands | Binding energies (kcal/mol) | ||||||
|---|---|---|---|---|---|---|---|
| 5m8s | 3lg0 | 4cox | 1i52 | 2zq0 | 4ibu | 1l6j | |
| Precocene I | −7 | −7.2 | −7.7 | −6.2 | −6.4 | −4.2 | −5.1 |
| Precocene II | −6.8 | −7 | −7.6 | −6 | −6 | −4.3 | −5.3 |
| VMDC | −7.4 | −8 | −7.5 | −6.3 | −6.1 | −4.6 | −5.3 |
| Beta-sitosterol | 1.8 | −8.3 | −8.9 | −6.6 | −2.5 | −2.7 | −6.9 |
| Stigmasterol | −2.8 | −8.4 | −7.4 | −6.8 | −4 | −3 | −6.6 |
| 5-Methoxynobiletin | −4.7 | −5.9 | −8.5 | −7 | −3.5 | −1.5 | −6.2 |
| Lycopsamine | −5.6 | −4.5 | −5.8 | −5.1 | −6.1 | −4.3 | −5.1 |