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Table 5 Binding energies of identified compounds after docking with enzymes

From: Secondary metabolic profiling, antioxidant potential, enzyme inhibitory activities and in silico and ADME studies: a multifunctional approach to reveal medicinal and industrial potential of Tanacetum falconeri

Sr.No

Compounds

AChE

BChE

É‘-Amylase

É‘-glucosidase

Tyrosinase

1

6-Caffeoylsucrose

-7.8

-8.8

-7.3

-8.1

-7.7

2

N-Acetyldehydroanonaine

-10.0

-10.9

-9.4

-8.7

-8.3

3

Bryaflavan

-8.0

-7.7

-8.0

-7.0

-7.2

4

Purpuritenin A

-8.6

-8.8

-7.9

-7.6

-6.7

5

3-O-Feruloylquinic acid

-7.5

-8.5

-7.8

-8.2

-6.9

6

Brosimacutin C

-8.5

-9.3

-8.7

-7.9

-7.5

7

Quinic acid

-6.1

-5.9

-5.8

-5.8

-5.3

8

Murrayazolinine

-9.0

-10.6

-9.0

-9,4

-8.1

9

Rutacultin

-6.5

-8.0

-7.0

-6.8

-6.6

10

Castamollissin

-9.2

-9.5

-8.6

-8.6

-8.1

11

9-Acetoxyfukinanolide

-7.7

-8.6

-7.3

-7.6

-6.2

12

Matteucinol

-9.3

8.1

-7.8

-7.4

-7.2

13

Kaempferol 3-p-coumarate

-8.7

-10.4

-8.5

-8.3

-9.0

14

Isocordoin

-8.9

-9.0

-8.4

-7.8

-7.3

15

Methylsyringin

-6.7

-7.0

-7.3

-7.3

-6.3

16

Kanzonol E

-10.0

-9.8

-9.6

-9.1

-8.7

17

Standard

-7.0a

-8.8a

-7.6b

-8.3b

-5.4c

  1. Standards: Galantamine (a), acarbose (b), and kojic acid (c). While AChE and BChE represent the acetylcholinesterase and butyrylcholinesterase respectively