Docking analysis in the molecular interaction between human AOX1 and bazedoxifene, lasofoxifene, and their structural analogs
| Experimental Rank (Based on IC50) | Parent Drug and Analogs | Log [IC50 (M)] | Binding Efficiency |
|---|---|---|---|
| Bazedoxifene and analogs | |||
| 1 | Des(1-azepanyl)ethylbazedoxifene | −7.00 | −0.938 |
| 2 | Bazedoxifene | −6.72 | −0.897 |
| 3 | Bazedoxifene N-oxide | −6.54 | −0.848 |
| Lasofoxifene and analogs | |||
| 1 | Lasofoxifene | −6.52 | −0.797 |
| 2 | 7-Methoxylasofoxifene | −5.81 | −0.790 |
| 3 | Cis-4-(1,2,3,4-tetrahydro-6-methoxy-2-phenyl-1-naphthalenyl)phenol | −5.63 | −0.761 |
| 4 | Nafoxidine | −5.60 | −0.787 |