Research Article
[Retracted] Targeting Streptomyces-Derived Streptenol Derivatives against Gynecological Cancer Target PIK3CA: An In Silico Approach
Table 3
Molecular docking study between streptenol derivatives along with PIK3CA revealed their intermolecular docking scores.
| Compound ID | Ligscore Dreiding 1 | Ligscore Dreiding 2 | PLP1 | PLP2 | JAIN | PMF | Dock score |
| 11769676-streptazolin | 1.34 | 3.66 | 50.37 | 37.05 | -0.56 | 40.84 | 47.889 | 132967417-streptenol F | 2.34 | 4.34 | 68.81 | 67.67 | -1.03 | 56.76 | 66.014 | 10947351-streptenol D | 2.89 | 4.4 | 70.14 | 72.76 | -0.82 | 38.44 | 66.355 | 15675440-streptenol B | 3.21 | 4.28 | 71.24 | 83.57 | 0.23 | 44.59 | 67.926 | 10921190-streptenol C | 1.97 | 3.53 | 71.93 | 77.56 | -0.48 | 34.43 | 68.057 | 10609345-streptenol E | 2.75 | 4.43 | 81.81 | 78.14 | 0 | 58.16 | 76.359 | 132967420-streptenol I | 1.88 | 4.8 | 94.65 | 93.04 | -0.77 | 68.86 | 88.275 | 132967418-streptenol G | 1.41 | 3.49 | 94.71 | 95.23 | -2.04 | 69.49 | 88.432 | 132967419-streptenol H | 2.36 | 4.49 | 100.65 | 95.99 | -1.3 | 76.04 | 96.081 | FDA-approved inhibitor-alpelisib | 2.16 | 4.32 | 98.59 | 91.62 | -1.1 | 72.08 | 95.917 |
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