Skip to main content

Table 1 Molecular docking results

From: Exploring the effect of Yinzhihuang granules on alcoholic liver disease based on pharmacodynamics, network pharmacology and molecular docking

NO

Proteins

PDB ID

Test compounds

Affinity (kcal/mol)

1

SRC

2H8H

Genkwanin

−9.0

2

SRC

2H8H

Norwogonin

−8.9

3

SRC

2H8H

Moslosooflavone

−8.6

4

SRC

2H8H

5,7,4'-Trihydroxy-8-methoxyflavone

−8.6

5

SRC

2H8H

3-Methylkempferol

−8.6

6

SRC

2H8H

5,2'-Dihydroxy-6,7,8-trimethoxyflavone

−8.4

7

EGFR

5WB7

5,7,4'-Trihydroxy-8-methoxyflavone

−8.3

8

EGFR

5WB7

Genkwanin

−8.2

9

EGFR

5WB7

Norwogonin

−8.0

10

SRC

2H8H

5,7,2,5-Tetrahydroxy-8,6-dimethoxyflavone

−7.8

11

EGFR

5WB7

Moslosooflavone

−7.8

12

EGFR

5WB7

4'-Methylcapillarisin

−7.8

13

EGFR

5WB7

5,7,2,5-Tetrahydroxy-8,6-dimethoxyflavone

−7.5

14

EGFR

5WB7

3-Methylkempferol

−7.5

15

EGFR

5WB7

5,2'-Dihydroxy-6,7,8-trimethoxyflavone

−7.1

16

AKT1

1UNQ

4'-Methylcapillarisin

−6.2

17

AKT1

1UNQ

5,7,2,5-Tetrahydroxy-8,6-dimethoxyflavone

−6.2

18

AKT1

1UNQ

3-Methylkempferol

−5.8