ligands in co-crystal #195 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: AMP-NSP3
NA_A-H2N2

Docking Scores:
-8.41 -7.78 -7.58
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
NA_A-H2N2

Docking Scores:
-6.94 -7.16 -6.63
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
NA_A-H2N2

Docking Scores:
-8.29 -8.25 -7.14
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
NA_A-H2N2

Docking Scores:
-6.94 -7.63 -6.86
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
NA_A-H2N2

Docking Scores:
-7.58 -7.89 -8.63
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
NA_A-H3N2

Docking Scores:
-7.76 -7.50
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
NA_A-H3N2

Docking Scores:
-6.48 -7.32
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
NA_A-H3N2

Docking Scores:
-6.89 -7.78
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
NA_A-H3N2

Docking Scores:
-6.34 -6.39
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
NA_A-H3N2

Docking Scores:
-7.59 -7.47
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
NA_A-H3N8

Docking Scores:
-7.73 -7.45 -7.82
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
NA_A-H3N8

Docking Scores:
-6.72 -7.59 -8.42
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
NA_A-H3N8

Docking Scores:
-7.51 -7.73 -7.59
Similarity Score:
N/A
Best Match:
N/A

L: MLN-4760-ACE2
NA_A-H3N8

Docking Scores:
-7.14 -7.35 -7.41
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
NA_A-H3N8

Docking Scores:
-8.16 -9.51 -7.49
Similarity Score:
N/A
Best Match:
N/A

L: AMP-NSP3
NA_A-H5N1

Docking Scores:
-7.35
Similarity Score:
N/A
Best Match:
N/A

L: S-Adenosylmethionine-NSP16
NA_A-H5N1

Docking Scores:
-7.39
Similarity Score:
N/A
Best Match:
N/A

L: SCHEMBL17719237-RDRP
NA_A-H5N1

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

L: MLN-4760-ACE2
NA_A-H5N1

Docking Scores:
-7.25
Similarity Score:
N/A
Best Match:
N/A

L: GTPL10716-3CLPro
NA_A-H5N1

Docking Scores:
-9.77
Similarity Score:
N/A
Best Match:
N/A