LTJv17 #93 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: 1-deoxymannojirimycin
PB4_A-H3N2

Docking Scores:
-4.84
Similarity Score:
N/A
Best Match:
N/A

L: Etravirine
PB4_A-H3N2

Docking Scores:
-8.40
Similarity Score:
N/A
Best Match:
N/A

L: Amprenavir
PB4_A-H3N2

Docking Scores:
-6.82
Similarity Score:
N/A
Best Match:
N/A

L: Letermovir
PB4_A-H3N2

Docking Scores:
-7.66
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PB4_A-H3N2

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A

L: 1-deoxymannojirimycin
PLP_SARS

Docking Scores:
-5.56 -5.28 -5.37
Similarity Score:
19.85%
Best Match:
CHEMBL213054

L: Etravirine
PLP_SARS

Docking Scores:
-8.05 -9.02 -8.50
Similarity Score:
21.81%
Best Match:
CHEMBL222735

L: Amprenavir
PLP_SARS

Docking Scores:
-7.83 -8.34 -8.28
Similarity Score:
30.35%
Best Match:
CHEMBL213054

L: Letermovir
PLP_SARS

Docking Scores:
-8.83 -9.25 -9.42
Similarity Score:
21.60%
Best Match:
CHEMBL358279

L: Tipranavir
PLP_SARS

Docking Scores:
-10.40 -9.98 -10.74
Similarity Score:
25.19%
Best Match:
CHEMBL212080

L: 1-deoxymannojirimycin
PR_FCoV

Docking Scores:
-4.59
Similarity Score:
N/A
Best Match:
N/A

L: Etravirine
PR_FCoV

Docking Scores:
-7.23
Similarity Score:
N/A
Best Match:
N/A

L: Amprenavir
PR_FCoV

Docking Scores:
-6.74
Similarity Score:
N/A
Best Match:
N/A

L: Letermovir
PR_FCoV

Docking Scores:
-8.86
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PR_FCoV

Docking Scores:
-7.97
Similarity Score:
N/A
Best Match:
N/A

L: 1-deoxymannojirimycin
PR_HCoV-229E

Docking Scores:
-4.40 -4.78
Similarity Score:
N/A
Best Match:
N/A

L: Etravirine
PR_HCoV-229E

Docking Scores:
-7.18 -6.58
Similarity Score:
N/A
Best Match:
N/A

L: Amprenavir
PR_HCoV-229E

Docking Scores:
-7.44 -6.92
Similarity Score:
N/A
Best Match:
N/A

L: Letermovir
PR_HCoV-229E

Docking Scores:
-7.76 -8.54
Similarity Score:
N/A
Best Match:
N/A

L: Tipranavir
PR_HCoV-229E

Docking Scores:
-7.88 -7.30
Similarity Score:
N/A
Best Match:
N/A