Research Article
Network Pharmacology-Based Strategy to Investigate Pharmacological Mechanisms of the Drug Pair Astragalus-Angelica for Treatment of Male Infertility
| | Ligand | Receptor (PDB ID) | Lowest binding energy (kJ/mol) |
| | Stigmasterol | EGF (1nql) | −14.0 | | Stigmasterol | EGFR (5ug9) | −11.5 | | Quercetin | EGF (1nql) | −11.5 | | Stigmasterol | ANXA1 (1mcx) | −11.0 | | Stigmasterol | IL6 (4cni) | −10.0 | | Stigmasterol | EGFR (5ug9) | −9.3 | | Quercetin | EGF (1nql) | −9.0 | | Kaempferol | IL6 (4cni) | −8.8 | | Kaempferol | TP53 (3d06) | −8.7 | | Kaempferol | EGF (1nql) | −8.5 | | Stigmasterol | TP53 (3d06) | −8.3 | | Stigmasterol | MAPK1 (2waj) | −7.5 | | Kaempferol | ANXA1 (1mcx) | −7.2 | | Quercetin | TP53 (3d06) | −6.9 | | Quercetin | ANXA1 (1mcx) | −5.7 | | Kaempferol | MAPK1 (2waj) | −5.0 | | Quercetin | IL6 (4cni) | −3.8 | | Quercetin | MAPK1 (2waj) | −2.8 |
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