Research Article
Scutellaria baicalensis in the Treatment of Hepatocellular Carcinoma: Network Pharmacology Analysis and Experimental Validation
Table 2
Results for molecular docking.
| Characteristics | PDB id | Active ingredients | Side length of the docking site | Docking coordinates | Combined energy (kcal/mol−1) |
| AKT1 | 2uzs | Baicalein | 40 | x = 20.035 | −7.2 | AKT1 | Oroxylin A | −6.1 | AKT1 | Rivularin | −5.6 | AKT1 | Wogonin | y = 0.360 | −6.7 | AKT1 | β-sitosterol | z = 8.631 | −7.2 | JUN | 1s9k | Baicalein | 40 | x = 28.874 | −7.8 | JUN | Oroxylin A | −7.8 | JUN | Rivularin | y = 28.619 | −7.2 | JUN | Wogonin | z = 60.875 | −7.2 | JUN | β-sitosterol | −7.5 | RELA | 1nfi | Baicalein | 40 | x = −5.372 | −7.4 | RELA | Oroxylin A | −7.1 | RELA | Rivularin | −6.9 | RELA | Wogonin | y = 65.520 | −7.1 | RELA | β-sitosterol | z = 45.295 | −6.8 |
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