3 drugs #235 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Ebselen
ACE2_HUMAN

Docking Scores:
-7.91
Similarity Score:
31.97%
Best Match:
CHEMBL76

L: Shikonin
ACE2_HUMAN

Docking Scores:
-8.48
Similarity Score:
27.16%
Best Match:
CHEMBL252003

L: Tideglusib
ACE2_HUMAN

Docking Scores:
-9.28
Similarity Score:
21.84%
Best Match:
CHEMBL429844

L: Ebselen
GP160_HIV1

Docking Scores:
-5.24 -5.22 -6.19
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
GP160_HIV1

Docking Scores:
-6.52 -5.61 -5.87
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
GP160_HIV1

Docking Scores:
-6.40 -6.49 -6.50
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
GP160_HIV2

Docking Scores:
-6.59
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
GP160_HIV2

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

L: Tideglusib
GP160_HIV2

Docking Scores:
-7.03
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
GP_EBOV

Docking Scores:
-7.31 -7.10 -6.52
Similarity Score:
23.14%
Best Match:
CHEMBL3125895

L: Shikonin
GP_EBOV

Docking Scores:
-7.77 -6.88 -7.52
Similarity Score:
20.49%
Best Match:
CHEMBL3125899

L: Tideglusib
GP_EBOV

Docking Scores:
-8.11 -9.12 -8.39
Similarity Score:
20.28%
Best Match:
CHEMBL3125895

L: Ebselen
HA_A-H10N7

Docking Scores:
-5.85
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H10N7

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

L: Tideglusib
HA_A-H10N7

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

L: Ebselen
HA_A-H10N8

Docking Scores:
-5.40
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H10N8

Docking Scores:
-6.43
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H10N8

Docking Scores:
-7.05
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H13N6

Docking Scores:
-5.90
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H13N6

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

L: Tideglusib
HA_A-H13N6

Docking Scores:
-7.04
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H14N6

Docking Scores:
-6.35
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H14N6

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

L: Tideglusib
HA_A-H14N6

Docking Scores:
-7.52
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H15N9

Docking Scores:
-5.78
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H15N9

Docking Scores:
-6.37
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H15N9

Docking Scores:
-6.87
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H17N10

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

L: Shikonin
HA_A-H17N10

Docking Scores:
-5.63
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H17N10

Docking Scores:
-6.23
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H18N11

Docking Scores:
-4.62
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H18N11

Docking Scores:
-5.77
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H18N11

Docking Scores:
-5.74
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H1N1

Docking Scores:
-5.71 -5.78
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H1N1

Docking Scores:
-7.11 -6.08
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H1N1

Docking Scores:
-7.19 -7.08
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H2N2

Docking Scores:
-5.88 -5.53
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H2N2

Docking Scores:
-6.84 -6.11
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H2N2

Docking Scores:
-6.78 -6.39
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H3N2

Docking Scores:
-5.66 -5.42 -5.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H3N2

Docking Scores:
-6.25 -5.88 -6.14
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H3N2

Docking Scores:
-7.05 -6.99 -6.98
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H3N8

Docking Scores:
-5.42 -5.52 -5.56
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H3N8

Docking Scores:
-6.14 -6.00 -5.99
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H3N8

Docking Scores:
-6.28 -6.29 -7.15
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H5N1

Docking Scores:
-6.54 -6.17 -6.09
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H5N1

Docking Scores:
-7.02 -6.77 -6.63
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H5N1

Docking Scores:
-7.57 -6.64 -6.81
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H5N3

Docking Scores:
-6.54 -5.81
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H5N3

Docking Scores:
-6.25 -6.36
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H5N3

Docking Scores:
-7.41 -6.16
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H6N1

Docking Scores:
-5.40
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H6N1

Docking Scores:
-6.43
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H6N1

Docking Scores:
-7.05
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H6N6

Docking Scores:
-5.47
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H6N6

Docking Scores:
-6.60
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H6N6

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

L: Ebselen
HA_A-H7N2

Docking Scores:
-5.88 -5.38 -5.68
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H7N2

Docking Scores:
-6.14 -5.84 -6.00
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H7N2

Docking Scores:
-7.12 -6.82 -6.84
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H7N7

Docking Scores:
-5.77 -5.64
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H7N7

Docking Scores:
-5.90 -6.85
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H7N7

Docking Scores:
-6.21 -6.84
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_A-H7N9

Docking Scores:
-5.78
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_A-H7N9

Docking Scores:
-6.76
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_A-H7N9

Docking Scores:
-7.15
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_INFB

Docking Scores:
-6.18 -5.45
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_INFB

Docking Scores:
-6.84 -6.34
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_INFB

Docking Scores:
-7.51 -6.37
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HA_INFD

Docking Scores:
-5.32
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HA_INFD

Docking Scores:
-6.95
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HA_INFD

Docking Scores:
-7.11
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HE_BCV

Docking Scores:
-6.40 -5.90
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HE_BCV

Docking Scores:
-6.71 -5.77
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HE_BCV

Docking Scores:
-7.06 -6.78
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HE_HCoV-OC43

Docking Scores:
-5.38
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HE_HCoV-OC43

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

L: Tideglusib
HE_HCoV-OC43

Docking Scores:
-6.75
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
HE_MHV

Docking Scores:
-5.53
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
HE_MHV

Docking Scores:
-6.07
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
HE_MHV

Docking Scores:
-6.87
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
IN_HIV1

Docking Scores:
-5.53 -5.36
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
IN_HIV1

Docking Scores:
-5.39 -5.81
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
IN_HIV1

Docking Scores:
-6.44 -6.64
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
MD_HKU4

Docking Scores:
-7.98 -7.60 -7.65
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
MD_HKU4

Docking Scores:
-7.99 -7.80 -8.07
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
MD_HKU4

Docking Scores:
-10.18 -9.58 -9.17
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
MD_MERs

Docking Scores:
-7.92 -7.68
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
MD_MERs

Docking Scores:
-8.09 -7.86
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
MD_MERs

Docking Scores:
-10.13 -9.54
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
MTASE_SARS2

Docking Scores:
-5.49
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
MTASE_SARS2

Docking Scores:
-6.85
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
MTASE_SARS2

Docking Scores:
-5.81
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
MTASE_SARS2

Docking Scores:
-7.40
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
MTASE_SARS2

Docking Scores:
-6.21
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
MTASE_SARS2

Docking Scores:
-8.67
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
MX2_A-H5N1

Docking Scores:
-8.43
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
MX2_A-H5N1

Docking Scores:
-9.05
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
MX2_A-H5N1

Docking Scores:
-8.11
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H11N6

Docking Scores:
-6.39 -6.42 -6.24
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H11N6

Docking Scores:
-7.19 -7.30 -6.68
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H11N6

Docking Scores:
-7.94 -7.67 -7.36
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H11N9

Docking Scores:
-7.02 -6.30 -6.53
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H11N9

Docking Scores:
-6.73 -7.32 -6.79
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H11N9

Docking Scores:
-7.17 -7.84 -7.65
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H12N5

Docking Scores:
-7.12 -6.44 -6.26
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H12N5

Docking Scores:
-6.98 -7.31 -7.20
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H12N5

Docking Scores:
-7.65 -8.00 -8.00
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H13N9

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

L: Shikonin
NA_A-H13N9

Docking Scores:
-6.52
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H13N9

Docking Scores:
-6.66
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H17N10

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

L: Shikonin
NA_A-H17N10

Docking Scores:
-6.44
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H17N10

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

L: Ebselen
NA_A-H18N11

Docking Scores:
-5.74
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H18N11

Docking Scores:
-6.44
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H18N11

Docking Scores:
-7.05
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H1N1

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

L: Shikonin
NA_A-H1N1

Docking Scores:
-7.13
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H1N1

Docking Scores:
-7.67
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H2N2

Docking Scores:
-6.11 -6.27 -6.28
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H2N2

Docking Scores:
-7.08 -7.70 -7.18
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H2N2

Docking Scores:
-8.20 -7.57 -7.76
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H3N2

Docking Scores:
-6.39 -6.31
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H3N2

Docking Scores:
-6.58 -6.35
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H3N2

Docking Scores:
-7.23 -6.88
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H3N8

Docking Scores:
-5.98 -7.62 -6.60
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H3N8

Docking Scores:
-7.08 -7.37 -7.55
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H3N8

Docking Scores:
-7.53 -8.23 -8.11
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H5N1

Docking Scores:
-6.22
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H5N1

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

L: Tideglusib
NA_A-H5N1

Docking Scores:
-7.74
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_A-H7N9

Docking Scores:
-6.70 -6.40 -6.63
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NA_A-H7N9

Docking Scores:
-6.79 -7.08 -7.36
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NA_A-H7N9

Docking Scores:
-7.50 -7.82 -7.77
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NA_INFB

Docking Scores:
-6.17 -6.27
Similarity Score:
18.32%
Best Match:
CHEMBL4161935

L: Shikonin
NA_INFB

Docking Scores:
-6.89 -7.32
Similarity Score:
32.20%
Best Match:
CHEMBL79499

L: Tideglusib
NA_INFB

Docking Scores:
-7.18 -7.66
Similarity Score:
21.36%
Best Match:
CHEMBL4175983

L: Ebselen
NP_A-H1N1

Docking Scores:
-6.25 -7.16 -6.87
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_A-H1N1

Docking Scores:
-6.16 -6.85 -6.16
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NP_A-H1N1

Docking Scores:
-7.09 -7.50 -7.46
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NP_A-H5N1

Docking Scores:
-6.30
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_A-H5N1

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

L: Tideglusib
NP_A-H5N1

Docking Scores:
-7.06
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NP_HCoV-NL63

Docking Scores:
-5.84
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_HCoV-NL63

Docking Scores:
-6.76
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NP_HCoV-NL63

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

L: Ebselen
NP_HCoV-OC43

Docking Scores:
-8.90 -7.26 -7.01
Similarity Score:
26.40%
Best Match:
CHEMBL3233481

L: Shikonin
NP_HCoV-OC43

Docking Scores:
-9.00 -7.21 -6.98
Similarity Score:
6.92%
Best Match:
CHEMBL3233481

L: Tideglusib
NP_HCoV-OC43

Docking Scores:
-9.36 -8.27 -8.09
Similarity Score:
17.42%
Best Match:
CHEMBL3233481

L: Ebselen
NP_INFB

Docking Scores:
-4.60
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_INFB

Docking Scores:
-5.37
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NP_INFB

Docking Scores:
-5.90
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NP_INFD

Docking Scores:
-5.22
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_INFD

Docking Scores:
-5.18
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NP_INFD

Docking Scores:
-5.84
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NP_SARS

Docking Scores:
-6.98
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NP_SARS

Docking Scores:
-7.56
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NP_SARS

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

L: Ebselen
NS3_HCV1A

Docking Scores:
-6.39 -5.84 -6.94
Similarity Score:
24.26%
Best Match:
CHEMBL4110215

L: Shikonin
NS3_HCV1A

Docking Scores:
-6.96 -6.45 -7.45
Similarity Score:
29.65%
Best Match:
CHEMBL3951374

L: Tideglusib
NS3_HCV1A

Docking Scores:
-6.61 -7.02 -9.16
Similarity Score:
21.88%
Best Match:
CHEMBL4110215

L: Ebselen
NS3_HCV1B

Docking Scores:
-6.80 -7.31 -5.88
Similarity Score:
19.47%
Best Match:
CHEMBL1170417

L: Shikonin
NS3_HCV1B

Docking Scores:
-7.70 -7.60 -6.60
Similarity Score:
20.12%
Best Match:
CHEMBL3927196

L: Tideglusib
NS3_HCV1B

Docking Scores:
-9.12 -8.05 -7.22
Similarity Score:
20.06%
Best Match:
CHEMBL297884

L: Ebselen
NS3_HCV3A

Docking Scores:
-7.58 -7.40 -7.28
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NS3_HCV3A

Docking Scores:
-7.10 -7.12 -7.40
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NS3_HCV3A

Docking Scores:
-7.67 -7.61 -7.54
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NS5B_HCV1A

Docking Scores:
-6.96 -7.62 -7.62
Similarity Score:
24.22%
Best Match:
CHEMBL363650

L: Shikonin
NS5B_HCV1A

Docking Scores:
-7.82 -8.96 -8.52
Similarity Score:
35.10%
Best Match:
CHEMBL446360

L: Tideglusib
NS5B_HCV1A

Docking Scores:
-8.03 -9.30 -9.50
Similarity Score:
21.74%
Best Match:
CHEMBL363650

L: Ebselen
NS5B_HCV1B

Docking Scores:
-6.79 -7.20 -7.41
Similarity Score:
23.71%
Best Match:
CHEMBL99408

L: Shikonin
NS5B_HCV1B

Docking Scores:
-7.57 -7.56 -7.57
Similarity Score:
20.53%
Best Match:
CHEMBL3645197

L: Tideglusib
NS5B_HCV1B

Docking Scores:
-8.58 -9.21 -8.64
Similarity Score:
21.53%
Best Match:
CHEMBL3645202

L: Ebselen
NS5B_HCV2A

Docking Scores:
-7.95 -7.75
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NS5B_HCV2A

Docking Scores:
-8.80 -8.35
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NS5B_HCV2A

Docking Scores:
-10.62 -10.23
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NSP15_SARS

Docking Scores:
-5.96
Similarity Score:
22.99%
Best Match:
CHEMBL3105073

L: Shikonin
NSP15_SARS

Docking Scores:
-6.87
Similarity Score:
21.90%
Best Match:
CHEMBL1092796

L: Tideglusib
NSP15_SARS

Docking Scores:
-7.42
Similarity Score:
20.00%
Best Match:
CHEMBL2441745

L: Ebselen
NSP15_SARS2

Docking Scores:
-6.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP15_SARS2

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

L: Tideglusib
NSP15_SARS2

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

L: Ebselen
NSP1_INFB

Docking Scores:
-6.20 -6.19
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP1_INFB

Docking Scores:
-6.09 -5.51
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NSP1_INFB

Docking Scores:
-7.00 -6.94
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NSP1_SARS

Docking Scores:
-5.56
Similarity Score:
22.99%
Best Match:
CHEMBL3105073

L: Shikonin
NSP1_SARS

Docking Scores:
-6.65
Similarity Score:
21.90%
Best Match:
CHEMBL1092796

L: Tideglusib
NSP1_SARS

Docking Scores:
-6.64
Similarity Score:
20.00%
Best Match:
CHEMBL2441745

L: Ebselen
NSP3_HCoV-229E

Docking Scores:
-7.92
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP3_HCoV-229E

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

L: Tideglusib
NSP3_HCoV-229E

Docking Scores:
-11.13
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NSP3_IBV

Docking Scores:
-8.15
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP3_IBV

Docking Scores:
-7.91
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NSP3_IBV

Docking Scores:
-10.77
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NSP3_MHV

Docking Scores:
-6.64
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP3_MHV

Docking Scores:
-6.67
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NSP3_MHV

Docking Scores:
-7.08
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
NSP3_SARS2

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

L: Shikonin
NSP3_SARS2

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

L: Tideglusib
NSP3_SARS2

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

L: Ebselen
NSP9_HCoV-229E

Docking Scores:
-5.95 -5.89
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
NSP9_HCoV-229E

Docking Scores:
-6.03 -6.27
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
NSP9_HCoV-229E

Docking Scores:
-8.61 -6.96
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PA_A-H17N10

Docking Scores:
-6.07
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PA_A-H17N10

Docking Scores:
-6.95
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PA_A-H17N10

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

L: Ebselen
PA_A-H1N1

Docking Scores:
-6.51 -7.14 -6.83
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PA_A-H1N1

Docking Scores:
-6.92 -7.61 -7.13
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PA_A-H1N1

Docking Scores:
-8.91 -8.67 -8.58
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PA_A-H5N1

Docking Scores:
-6.83 -6.27 -6.80
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PA_A-H5N1

Docking Scores:
-7.42 -7.46 -7.26
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PA_A-H5N1

Docking Scores:
-8.71 -8.31 -8.70
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PA_INFA

Docking Scores:
-8.02 -6.31 -6.29
Similarity Score:
23.57%
Best Match:
CHEMBL278402

L: Shikonin
PA_INFA

Docking Scores:
-8.11 -7.18 -7.15
Similarity Score:
40.80%
Best Match:
CHEMBL573638

L: Tideglusib
PA_INFA

Docking Scores:
-9.91 -7.70 -8.53
Similarity Score:
22.22%
Best Match:
CHEMBL463590

L: Ebselen
PA_INFB

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

L: Shikonin
PA_INFB

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

L: Tideglusib
PA_INFB

Docking Scores:
-8.50
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PB2_A-H3N2

Docking Scores:
-6.96 -7.61
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PB2_A-H3N2

Docking Scores:
-7.85 -8.57
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PB2_A-H3N2

Docking Scores:
-8.39 -9.07
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PB2_A-H5N1

Docking Scores:
-6.93 -7.03 -7.38
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PB2_A-H5N1

Docking Scores:
-7.15 -7.30 -8.05
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PB2_A-H5N1

Docking Scores:
-7.92 -7.64 -9.17
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PB2_INFB

Docking Scores:
-7.60
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PB2_INFB

Docking Scores:
-8.61
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PB2_INFB

Docking Scores:
-9.48
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PB3_A-H3N2

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

L: Shikonin
PB3_A-H3N2

Docking Scores:
-8.66
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PB3_A-H3N2

Docking Scores:
-9.12
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PB4_A-H3N2

Docking Scores:
-7.31
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PB4_A-H3N2

Docking Scores:
-8.47
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PB4_A-H3N2

Docking Scores:
-9.03
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PLP_SARS

Docking Scores:
-7.72 -7.72 -7.65
Similarity Score:
21.11%
Best Match:
CHEMBL222893

L: Shikonin
PLP_SARS

Docking Scores:
-8.69 -8.05 -8.14
Similarity Score:
25.13%
Best Match:
CHEMBL213543

L: Tideglusib
PLP_SARS

Docking Scores:
-8.62 -9.81 -9.38
Similarity Score:
21.00%
Best Match:
CHEMBL222893

L: Ebselen
PLP_SARS2

Docking Scores:
-5.54
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PLP_SARS2

Docking Scores:
-6.55
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PLP_SARS2

Docking Scores:
-6.47
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_FCoV

Docking Scores:
-6.56
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_FCoV

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

L: Tideglusib
PR_FCoV

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

L: Ebselen
PR_HCoV-229E

Docking Scores:
-6.43 -6.36
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HCoV-229E

Docking Scores:
-6.58 -6.42
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HCoV-229E

Docking Scores:
-7.99 -7.29
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HCoV-NL63

Docking Scores:
-4.68 -6.86
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HCoV-NL63

Docking Scores:
-5.43 -7.05
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HCoV-NL63

Docking Scores:
-5.53 -8.21
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HIV1

Docking Scores:
-6.55 -6.34 -6.18
Similarity Score:
17.31%
Best Match:
CHEMBL494500

L: Shikonin
PR_HIV1

Docking Scores:
-6.73 -6.71 -6.65
Similarity Score:
21.08%
Best Match:
CHEMBL492666

L: Tideglusib
PR_HIV1

Docking Scores:
-7.34 -6.96 -7.40
Similarity Score:
18.26%
Best Match:
CHEMBL492666

L: Ebselen
PR_HIV2

Docking Scores:
-6.92 -5.45
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HIV2

Docking Scores:
-7.11 -5.94
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HIV2

Docking Scores:
-7.96 -6.96
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_HKU1

Docking Scores:
-6.57
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HKU1

Docking Scores:
-6.07
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HKU1

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

L: Ebselen
PR_HKU4

Docking Scores:
-6.21 -6.59 -6.58
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_HKU4

Docking Scores:
-6.81 -6.88 -7.09
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_HKU4

Docking Scores:
-7.40 -8.14 -8.20
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_IBV

Docking Scores:
-6.26
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_IBV

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

L: Tideglusib
PR_IBV

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

L: Ebselen
PR_MERs

Docking Scores:
-6.31 -6.44
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_MERs

Docking Scores:
-6.60 -7.25
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_MERs

Docking Scores:
-7.49 -8.38
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_PEDV

Docking Scores:
-6.33
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_PEDV

Docking Scores:
-6.98
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_PEDV

Docking Scores:
-8.11
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
PR_SARS

Docking Scores:
-6.76 -6.91 -6.25
Similarity Score:
22.99%
Best Match:
CHEMBL3105073

L: Shikonin
PR_SARS

Docking Scores:
-6.71 -7.37 -6.89
Similarity Score:
21.90%
Best Match:
CHEMBL1092796

L: Tideglusib
PR_SARS

Docking Scores:
-7.92 -7.28 -7.87
Similarity Score:
20.00%
Best Match:
CHEMBL2441745

L: Ebselen
PR_SARS2

Docking Scores:
-6.55
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_SARS2

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

L: Tideglusib
PR_SARS2

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

L: Ebselen
PR_TGEV

Docking Scores:
-6.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
PR_TGEV

Docking Scores:
-6.66
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
PR_TGEV

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

L: Ebselen
RDRP_SARS2

Docking Scores:
-5.74
Similarity Score:
12.82%
Best Match:
CHEMBL4065616

L: Shikonin
RDRP_SARS2

Docking Scores:
-5.88
Similarity Score:
17.04%
Best Match:
CHEMBL4065616

L: Tideglusib
RDRP_SARS2

Docking Scores:
-6.85
Similarity Score:
17.50%
Best Match:
CHEMBL4065616

L: Ebselen
RT_HIV1

Docking Scores:
-8.66 -9.09 -8.80
Similarity Score:
24.60%
Best Match:
CHEMBL4108806

L: Shikonin
RT_HIV1

Docking Scores:
-10.00 -9.87 -9.00
Similarity Score:
40.15%
Best Match:
CHEMBL3775172

L: Tideglusib
RT_HIV1

Docking Scores:
-10.70 -10.00 -10.41
Similarity Score:
23.51%
Best Match:
CHEMBL3928841

L: Ebselen
SPIKE_HCoV-229E

Docking Scores:
-4.87
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HCoV-229E

Docking Scores:
-4.82
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_HCoV-229E

Docking Scores:
-5.86
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HCoV-NL63

Docking Scores:
-5.13
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HCoV-NL63

Docking Scores:
-5.94
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_HCoV-NL63

Docking Scores:
-7.34
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HCoV-OC43

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

L: Shikonin
SPIKE_HCoV-OC43

Docking Scores:
-6.36
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_HCoV-OC43

Docking Scores:
-7.04
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_HKU4

Docking Scores:
-5.67
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_HKU4

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

L: Tideglusib
SPIKE_HKU4

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

L: Ebselen
SPIKE_IBV

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

L: Shikonin
SPIKE_IBV

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

L: Tideglusib
SPIKE_IBV

Docking Scores:
-6.49
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_MERs

Docking Scores:
-6.06 -5.56 -4.90
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_MERs

Docking Scores:
-6.57 -6.07 -5.44
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_MERs

Docking Scores:
-7.20 -7.00 -6.24
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_MHV

Docking Scores:
-6.26
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_MHV

Docking Scores:
-6.61
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_MHV

Docking Scores:
-7.06
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_PDCoV

Docking Scores:
-5.37
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_PDCoV

Docking Scores:
-5.90
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_PDCoV

Docking Scores:
-7.00
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_SARS

Docking Scores:
-5.76 -6.18
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_SARS

Docking Scores:
-7.12 -6.31
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_SARS

Docking Scores:
-7.25 -7.15
Similarity Score:
N/A
Best Match:
N/A

L: Ebselen
SPIKE_SARS2

Docking Scores:
-5.31 -5.30 -5.72
Similarity Score:
N/A
Best Match:
N/A

L: Shikonin
SPIKE_SARS2

Docking Scores:
-5.74 -6.44 -6.29
Similarity Score:
N/A
Best Match:
N/A

L: Tideglusib
SPIKE_SARS2

Docking Scores:
-6.53 -6.76 -7.18
Similarity Score:
N/A
Best Match:
N/A