07 November 2022 : Database Analysis
Mechanism of Progesterone in Treatment of Traumatic Brain Injury Based on Network Pharmacology and Molecular Docking Technology
Chen Zheng1ABCDEFG, Jian Gong1CEF, Lili Zang2CDEF, Daiying Song2BCDF, Xinyue Ran2CDF, Juncen Li2BCDE, Bo Jiang1DF, Jianli Xu1BC, Qihua Wu1ACDFG*DOI: 10.12659/MSM.937564
Med Sci Monit 2022; 28:e937564
Table 1 Top 20 progesterone-related targets in descending order of standardized fit scores.
| Rank | PDB ID | Target name | Number of features | Fit score | Normalized fit score | z’-score |
|---|---|---|---|---|---|---|
| 1 | 1reu_v | Bone morphogenetic protein 2 | 3 | 2.973 | 0.9911 | 0.980898 |
| 2 | 1okl_v | Carbonic anhydrase 2 | 3 | 2.934 | 0.978 | 1.10765 |
| 3 | 2p3g_v | MAP kinase-activated protein kinase 2 | 3 | 2.898 | 0.9661 | 0.966279 |
| 4 | 1dvz_v | Transthyretin | 3 | 2.894 | 0.9648 | 1.01366 |
| 5 | 2aa6_v | Mineralocorticoid receptor | 5 | 4.806 | 0.9612 | 4.51104 |
| 6 | 2pit_v | Androgen receptor | 3 | 2.879 | 0.9596 | 0.967023 |
| 7 | 2ocf_v | Estrogen receptor | 3 | 2.865 | 0.955 | 0.931076 |
| 8 | 1a28_v | Progesterone receptor | 4 | 3.801 | 0.9502 | 3.28058 |
| 9 | 3eqm_v | Cytochrome P450 19A1 | 3 | 2.831 | 0.9438 | 0.849743 |
| 10 | 1qyx_v | Estradiol 17-beta-dehydrogenase 1 | 5 | 4.692 | 0.9384 | 3.88391 |
| 11 | 2uzd_v | Cyclin-A2 | 3 | 2.787 | 0.9289 | 0.830167 |
| 12 | 1j96_v | Aldo-keto reductase family 1 member C2 | 3 | 2.747 | 0.9156 | 0.488136 |
| 13 | 1p49_v | Steryl-sulfatase | 3 | 2.719 | 0.9064 | 0.46795 |
| 14 | 1xf0_v | Aldo-keto reductase family 1 member C3 | 3 | 2.718 | 0.9059 | 0.668436 |
| 15 | 1shj_v | Caspase-7 | 3 | 2.685 | 0.8951 | 0.322237 |
| 16 | 1e7a_v | Serum albumin | 3 | 2.649 | 0.8831 | 0.468333 |
| 17 | 1xdd_v | Integrin alpha-L | 3 | 2.63 | 0.8768 | 0.262544 |
| 18 | 2obj_v | Proto-oncogene serine/threonine-protein kinase Pim-1 | 3 | 2.567 | 0.8555 | 0.165933 |
| 19 | 1zxc_v | ADAM 17 | 4 | 3.395 | 0.8488 | 1.79712 |
| 20 | 1l6l_v | Apolipoprotein A-II | 3 | 2.524 | 0.8412 | 0.0122296 |