Sitagliptin #236 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

PR_FCoV

Docking Scores:
-8.05
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-229E

Docking Scores:
-8.03 -7.68
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-4.92 -8.79
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.97 -7.30 -6.66
Similarity Score:
25.62%
Best Match:
CHEMBL3645124

PR_HIV2

Docking Scores:
-7.28 -6.84
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

Docking Scores:
-7.50
Similarity Score:
N/A
Best Match:
N/A

PR_HKU4

Docking Scores:
-8.25 -7.64 -7.41
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

Docking Scores:
-8.17
Similarity Score:
N/A
Best Match:
N/A

PR_MERs

Docking Scores:
-8.55 -8.17
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

Docking Scores:
-8.31
Similarity Score:
N/A
Best Match:
N/A

PR_SARS

Docking Scores:
-8.06 -8.26 -8.33
Similarity Score:
29.67%
Best Match:
CHEMBL2441745

PR_SARS2

Docking Scores:
-8.20
Similarity Score:
N/A
Best Match:
N/A

PR_TGEV

Docking Scores:
-7.87
Similarity Score:
N/A
Best Match:
N/A

RDRP_SARS2

Docking Scores:
-7.23
Similarity Score:
19.71%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-9.89 -10.59 -10.22
Similarity Score:
34.03%
Best Match:
CHEMBL4225865

SPIKE_HCoV-229E

Docking Scores:
-5.24
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-NL63

Docking Scores:
-6.46
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-OC43

Docking Scores:
-6.81
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HKU4

Docking Scores:
-6.99
Similarity Score:
N/A
Best Match:
N/A

SPIKE_IBV

Docking Scores:
-6.73
Similarity Score:
N/A
Best Match:
N/A