vc1784 #326 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: 2 Coumarinate
PA_A-H5N1

Docking Scores:
-5.80 -5.39 -5.88
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PA_A-H5N1

Docking Scores:
-9.69 -9.06 -8.96
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PA_INFA

Docking Scores:
-6.88 -5.33 -5.38
Similarity Score:
35.71%
Best Match:
CHEMBL573638

L: Agapanthagenin
PA_INFA

Docking Scores:
-9.27 -9.29 -9.31
Similarity Score:
11.40%
Best Match:
CHEMBL2040554

L: 2 Coumarinate
PA_INFB

Docking Scores:
-5.33
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PA_INFB

Docking Scores:
-8.84
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PB2_A-H3N2

Docking Scores:
-5.46 -5.79
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PB2_A-H3N2

Docking Scores:
-8.38 -7.43
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PB2_A-H5N1

Docking Scores:
-5.68 -5.98 -5.88
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PB2_A-H5N1

Docking Scores:
-7.55 -7.62 -8.13
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PB2_INFB

Docking Scores:
-6.14
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PB2_INFB

Docking Scores:
-8.32
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PB3_A-H3N2

Docking Scores:
-5.44
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PB3_A-H3N2

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

L: 2 Coumarinate
PB4_A-H3N2

Docking Scores:
-5.48
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PB4_A-H3N2

Docking Scores:
-8.89
Similarity Score:
N/A
Best Match:
N/A

L: 2 Coumarinate
PLP_SARS

Docking Scores:
-6.73 -6.83 -6.69
Similarity Score:
23.71%
Best Match:
CHEMBL212454

L: Agapanthagenin
PLP_SARS

Docking Scores:
-8.00 -7.96 -8.17
Similarity Score:
11.35%
Best Match:
CHEMBL213054

L: 2 Coumarinate
PLP_SARS2

Docking Scores:
-5.35
Similarity Score:
N/A
Best Match:
N/A

L: Agapanthagenin
PLP_SARS2

Docking Scores:
-7.55
Similarity Score:
N/A
Best Match:
N/A