Research Article

Mode of Action of Shan-Zhu-Yu (Cornus officinalis Sieb. et Zucc.) in the Treatment of Depression Based on Network Pharmacology

Table 3

Molecular docking results.

CompoundCompound 2D structureTarget and PDB IDStructure with initial ligandGrid box sizeAffinity (kcal/mol)

Telocinobufagin (CAS: 472-26-4)NR3C1 (1NHZ)808080−9.43
Bax (homology modeling)909090−7.9
Beta-sitosterol (CAS: 83-46-5)Bcl-2 (homology modeling)707070−8.21
Caspase-3 (1NMS)909090−7.16