Table 6.
Compound Name | Docking Score | ||||
---|---|---|---|---|---|
4U14 | 5AIN | 5LAQ | 4JOM | 4R7U | |
2,4-Di-tert-butylphenol | −8.14 | −5.89 | −8.37 | −4.92 | −4.85 |
Pentadecene | −0.08 | +2.61 | +1.45 | +3.81 | +3.46 |
Nonadecene | −0.84 | +0.96 | −0.75 | +3.53 | +2.18 |
Methyl palmitate | −2.16 | −0.27 | −1.69 | +1.79 | +1.80 |
Palmitic acid | −1.54 | +0.09 | −1.63 | +1.28 | +1.84 |
Behenic alcohol | −5.23 | −3.28 | −5.66 | −1.15 | −2.78 |
Methyl lineoleate | −3.75 | −1.75 | −3.09 | +0.68 | +0.67 |
Methyl elaidolinolenate | −3.96 | −2.03 | −2.39 | +1.29 | −0.44 |
Linoleic acid | −3.85 | −0.72 | −3.47 | +0.73 | +0.25 |
Linolenic acid | −2.94 | −1.00 | −3.99 | −0.05 | +0.01 |
Reference drug | −7.28 | − | −5.93 | −4.17 | −4.57 |
Docking scores in Kcal/mol; bold text indicates the highest score.