BioMed Research International / 2023 / Article / Tab 3 / Research Article
Investigation on the Mechanisms of Zanthoxylum bungeanum for Treating Diabetes Mellitus Based on Network Pharmacology, Molecular Docking, and Experiment Verification Table 3 The results of molecular docking.
Compound Target PDB Libdock score Kokusaginin AKT1 1 h10 40.36 Skimmianin AKT1 1 h10 26.46 Diosmetin AKT1 1 h10 56.65 Beta-sitosterol AKT1 1 h10 67.85 Quercetin AKT1 1 h10 56.04 Kokusaginin IL6 1alu 66.33 Skimmianin IL6 1alu 77.02 Diosmetin IL6 1alu 79.18 Beta-sitosterol IL6 1alu 70.68 Quercetin IL6 1alu 71.44 Kokusaginin HSP90AA1 1byq 88.68 Skimmianin HSP90AA1 1byq 73.36 Diosmetin HSP90AA1 1byq 91.09 Beta-sitosterol HSP90AA1 1byq 0 Quercetin HSP90AA1 1byq 89.96 Kokusaginin FOS 1a02 93.34 Skimmianin FOS 1a02 87.24 Diosmetin FOS 1a02 105.47 Beta-sitosterol FOS 1a02 118.17 Quercetin FOS 1a02 107.43 Kokusaginin JUN 1jnm 98.24 Skimmianin JUN 1jnm 0 Diosmetin JUN 1jnm 120.99 Beta-sitosterol JUN 1jnm 125.09 Quercetin JUN 1jnm 104.87