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Table 3 Molecular docking of selective components with pathway proteins

From: In vitro and in silico analysis of ‘Taikong blue’ lavender essential oil in LPS-induced HaCaT cells and RAW264.7 murine macrophages

Compound

IKB-α

JNK

p50

p65

p38

Human

Mice

Human

Mice

Human

Mice

Human

Mice

Human

Mice

Linalyl acetate

-4.1

-4.3

-6.3

-6.3

-5.8

-5.2

-5.0

-4.7

-5.5

-5.6

linalool

-3.9

-4.2

-5.6

-5.2

-5.8

-5.2

-5.0

-4.6

-5.1

-5.2

Lavandulol acetate

-4.2

-4.4

-6.4

-6.2

-6.2

-5.6

-5.2

-5.1

-5.8

-5.7

cis-β-Ocimene

-3.9

-4.1

-6.2

-5.7

-5.8

-5.0

-5.0

-4.4

-5.2

-4.7

1-Octen-3-yl-acetate

-3.8

-3.9

-5.6

-5.4

-5.1

-4.6

-4.6

-4.3

-5.0

-5.1

Caryophyllene

-4.9

-4.9

-7.2

-7.5

-6.0

-6.0

-6.1

-5.4

-7.1

-7.2

Terpinen-4-ol

-4.2

-4.5

-6.1

-5.5

-6.0

-5.1

-5.3

-5.0

-5.6

-5.5

(4E,6E)-Alloocimene

-4.2

-4.3

-6.5

-6.0

-6.1

-5.1

-5.5

-4.8

-5.2

-5.3

β-Ocimene

-4.0

-4.0

-6.4

-5.9

-5.8

-4.5

-4.9

-4.6

-5.1

-4.9

Geranyl acetate

-4.5

-4.4

-6.7

-6.4

-6.1

-5.2

-5.6

-4.6

-5.8

-5.7

β-Myrcene

-4.0

-4.2

-6.1

-5.6

-5.6

-4.9

-4.9

-4.2

-5.0

-4.8