Table 1.
Docking results of oxadiazole derivatives Ox-6a-f against COX-2 and COX-1 using AutoDock.
| Compounds | Binding Energy (kcal/mol) (COX-2) (PDBID 5KIR) |
Binding Energy (kcal/mol) (COX-1) (PDBID 6Y3C) |
Binding Energy (kcal/mol) (NOX) (PDBID 7U8G) |
|---|---|---|---|
| Ox-6a | −7.10 | −6.30 | −7.10 |
| Ox-6b | −6.40 | −6.10 | −6.70 |
| Ox-6c | −6.60 | −6.20 | −7.40 |
| Ox-6d | −7.30 | −6.70 | −7.90 |
| Ox-6e | −6.90 | −6.40 | −7.50 |
| Ox-6f | −7.70 | −6.80 | −8.10 |