Table 2.
Ligand | Energy (kcal/mol) | Est. Inhibition Constant, Ki* (µM or ηM) |
---|---|---|
Prostaglandin E2 (Natural ligand) | −4.8 | 433.11 µM |
Celecoxib | −10.4 | 70.80 ηM |
Diclofenac | −8.4 | 13.2 µM |
Meloxicam | −9.1 | 3.02 µM |
Naproxen | −8.4 | 14.26 µM |
1,8-Cineole | −6.0 | 31.12 µM |
* Theorical Inhibition Constant calculated by autodock function. Ki unit is µM = micromoles or ηM = nanomols.