LTJv19 #100 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Canagliflozin
PR_SARS

Docking Scores:
-8.24 -8.08 -8.34
Similarity Score:
21.86%
Best Match:
CHEMBL2441745

L: Metformin
PR_SARS

Docking Scores:
-4.80 -5.00 -4.81
Similarity Score:
3.10%
Best Match:
CHEMBL3105073

L: Glimepiride
PR_SARS

Docking Scores:
-8.33 -8.51 -7.97
Similarity Score:
31.07%
Best Match:
CHEMBL2441741

L: Glipizide
PR_SARS

Docking Scores:
-7.65 -8.20 -7.59
Similarity Score:
27.60%
Best Match:
CHEMBL2441741

L: Sitagliptin
PR_SARS

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

L: Canagliflozin
PR_SARS2

Docking Scores:
-7.72
Similarity Score:
N/A
Best Match:
N/A

L: Metformin
PR_SARS2

Docking Scores:
-4.73
Similarity Score:
N/A
Best Match:
N/A

L: Glimepiride
PR_SARS2

Docking Scores:
-7.83
Similarity Score:
N/A
Best Match:
N/A

L: Glipizide
PR_SARS2

Docking Scores:
-7.78
Similarity Score:
N/A
Best Match:
N/A

L: Sitagliptin
PR_SARS2

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

L: Canagliflozin
PR_TGEV

Docking Scores:
-8.28
Similarity Score:
N/A
Best Match:
N/A

L: Metformin
PR_TGEV

Docking Scores:
-4.64
Similarity Score:
N/A
Best Match:
N/A

L: Glimepiride
PR_TGEV

Docking Scores:
-8.88
Similarity Score:
N/A
Best Match:
N/A

L: Glipizide
PR_TGEV

Docking Scores:
-7.99
Similarity Score:
N/A
Best Match:
N/A

L: Sitagliptin
PR_TGEV

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

L: Canagliflozin
RT_HIV1

Docking Scores:
-9.66 -9.59 -9.73
Similarity Score:
30.36%
Best Match:
CHEMBL4108147

L: Metformin
RT_HIV1

Docking Scores:
-5.32 -5.41 -5.53
Similarity Score:
4.12%
Best Match:
CHEMBL4228598

L: Glimepiride
RT_HIV1

Docking Scores:
-10.16 -10.98 -10.68
Similarity Score:
45.91%
Best Match:
CHEMBL4225004

L: Glipizide
RT_HIV1

Docking Scores:
-9.55 -10.35 -9.24
Similarity Score:
42.74%
Best Match:
CHEMBL3921297

L: Sitagliptin
RT_HIV1

Docking Scores:
-10.12 -10.59 -10.37
Similarity Score:
34.03%
Best Match:
CHEMBL4225865