Table 5.
∆G Binding affinity (kcal/mol) for each ligand with Hippo signaling pathway proteins
| Name of the ligand |
MST1
|
LATS1
|
YAP
|
TAZ
|
|
Binding free energy (kcal/mol)
| ||||
| Caffeic acid | -6.9 | -6.1 | -5.5 | -4.8 |
| Chlorogenic | -7.6 | -7.7 | -6.8 | -5.8 |
| Cinnamic acid | -6.3 | -6 | -5.7 | -4.6 |
| Coumaric acid | -6.5 | -6.1 | -5.8 | -4.8 |
| Ellagic acid | -8.7 | -7.7 | -6 | -6.3 |
| Ferulic acid | -7 | -6.3 | -5.5 | -4.6 |
| Gallic acid | -5.8 | -6.2 | -5 | -4.5 |
| Hesperetin | -8 | -7.3 | -6.6 | -6.3 |
| Methyl gallate | -5.8 | -5.4 | -4.9 | -4.4 |
| Naringenin | -7.8 | -8.1 | -6.5 | -6.1 |
| Quercetin | -7.4 | -8.3 | -6.5 | -6 |
| Rosmarinic | -7.9 | -7.2 | -6.5 | -6.1 |
| Rutin | -8.3 | -8.9 | -7.5 | -7.4 |
| Syringic acid | -5.9 | -5.4 | -5 | -4.2 |
| Vanillin | -5.7 | -5.2 | -4.6 | -3.9 |
MST1: Mammalian sterile 20-like kinase 1, LATS1: Large tumor suppressor kinase 1, YAP: Yes-associated protein, TAZ: Transcriptional coactivator with PDZ-binding motif.