1 #258 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Ethyl ferulate
ACE2_HUMAN

Docking Scores:
-6.70
Similarity Score:
25.78%
Best Match:
CHEMBL252003

L: Galuteolin
ACE2_HUMAN

Docking Scores:
-10.33
Similarity Score:
21.60%
Best Match:
CHEMBL254495

L: Ferulic acid
ACE2_HUMAN

Docking Scores:
-6.49
Similarity Score:
27.05%
Best Match:
CHEMBL252003

L: Cryptotanshinone
ACE2_HUMAN

Docking Scores:
-9.84
Similarity Score:
21.86%
Best Match:
CHEMBL252009

L: Chlorogenic acid
ACE2_HUMAN

Docking Scores:
-8.56
Similarity Score:
25.18%
Best Match:
CHEMBL253224

L: Ethyl ferulate
GP160_HIV1

Docking Scores:
-6.02 -6.01 -5.20
Similarity Score:
N/A
Best Match:
N/A

L: Galuteolin
GP160_HIV1

Docking Scores:
-7.12 -7.51 -7.03
Similarity Score:
N/A
Best Match:
N/A

L: Ferulic acid
GP160_HIV1

Docking Scores:
-5.38 -5.31 -5.90
Similarity Score:
N/A
Best Match:
N/A

L: Cryptotanshinone
GP160_HIV1

Docking Scores:
-6.39 -6.53 -6.51
Similarity Score:
N/A
Best Match:
N/A

L: Chlorogenic acid
GP160_HIV1

Docking Scores:
-7.89 -7.91 -7.89
Similarity Score:
N/A
Best Match:
N/A

L: Ethyl ferulate
GP160_HIV2

Docking Scores:
-6.05
Similarity Score:
N/A
Best Match:
N/A

L: Galuteolin
GP160_HIV2

Docking Scores:
-7.46
Similarity Score:
N/A
Best Match:
N/A

L: Ferulic acid
GP160_HIV2

Docking Scores:
-5.76
Similarity Score:
N/A
Best Match:
N/A

L: Cryptotanshinone
GP160_HIV2

Docking Scores:
-6.62
Similarity Score:
N/A
Best Match:
N/A

L: Chlorogenic acid
GP160_HIV2

Docking Scores:
-7.03
Similarity Score:
N/A
Best Match:
N/A

L: Ethyl ferulate
GP_EBOV

Docking Scores:
-5.85 -5.84 -5.80
Similarity Score:
13.41%
Best Match:
CHEMBL3125899

L: Galuteolin
GP_EBOV

Docking Scores:
-8.40 -8.02 -7.75
Similarity Score:
16.92%
Best Match:
CHEMBL3125899

L: Ferulic acid
GP_EBOV

Docking Scores:
-6.28 -5.37 -6.45
Similarity Score:
13.17%
Best Match:
CHEMBL3125895

L: Cryptotanshinone
GP_EBOV

Docking Scores:
-8.53 -8.96 -8.34
Similarity Score:
21.59%
Best Match:
CHEMBL3125899

L: Chlorogenic acid
GP_EBOV

Docking Scores:
-7.11 -7.26 -6.75
Similarity Score:
22.04%
Best Match:
CHEMBL3125897