Table 2.
Molecular docking results of TP with core acting targets.
| Target | Binding energy (kJ/mol) | Target | Binding energy (kJ/mol) |
|---|---|---|---|
| STAT1 | –7.83 | TP53 | –7.42 |
| CASP8 | –7.78 | PTGS2 | –7.38 |
| CXCR4 | –7.77 | RELA | –7.20 |
| PTEN | –7.60 | CASP3 | –7.20 |
| ESR1 | –7.58 | IL6 | –7.16 |
| GSK3B | –7.58 | CDKN1A | –7.13 |
| TNF | –7.50 | HIF1A | –6.86 |
| JAK2 | –7.49 | STAT3 | –6.82 |
| TGFB1 | –7.48 | VEGFA | –6.54 |
| NFE2L2 | –7.45 | JUN | –6.54 |
ESR = estrogen receptor, JAK = Janus kinase, STAT3 = signal transducer and activator of transcription 3, TNF = tumor necrosis factor, TP = triptolide, VEGFA = vascular endothelial growth factor A.