3-DRUGS #106 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Saquinavir
GP160_HIV1

Docking Scores:
-8.07 -8.88 -8.89
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
GP160_HIV1

Docking Scores:
-8.02 -8.18 -7.38
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
GP160_HIV1

Docking Scores:
-7.88 -8.31 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
GP160_HIV2

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

L: Bictegravir
GP160_HIV2

Docking Scores:
-8.60
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
GP160_HIV2

Docking Scores:
-8.83
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
GP_EBOV

Docking Scores:
-8.64 -8.49 -8.55
Similarity Score:
45.82%
Best Match:
CHEMBL3125895

L: Bictegravir
GP_EBOV

Docking Scores:
-9.34 -9.70 -8.73
Similarity Score:
31.95%
Best Match:
CHEMBL3125895

L: Paritaprevir
GP_EBOV

Docking Scores:
-9.87 -9.28 -9.51
Similarity Score:
39.82%
Best Match:
CHEMBL3125899

L: Saquinavir
HA_A-H10N7

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

L: Bictegravir
HA_A-H10N7

Docking Scores:
-8.76
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H10N7

Docking Scores:
-8.62
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H10N8

Docking Scores:
-7.07
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H10N8

Docking Scores:
-7.43
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H10N8

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

L: Saquinavir
HA_A-H13N6

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

L: Bictegravir
HA_A-H13N6

Docking Scores:
-5.11
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H13N6

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

L: Saquinavir
HA_A-H14N6

Docking Scores:
-8.34
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H14N6

Docking Scores:
-8.81
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H14N6

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

L: Saquinavir
HA_A-H15N9

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

L: Bictegravir
HA_A-H15N9

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

L: Paritaprevir
HA_A-H15N9

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

L: Saquinavir
HA_A-H17N10

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

L: Bictegravir
HA_A-H17N10

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

L: Paritaprevir
HA_A-H17N10

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

L: Saquinavir
HA_A-H18N11

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

L: Bictegravir
HA_A-H18N11

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

L: Paritaprevir
HA_A-H18N11

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

L: Saquinavir
HA_A-H1N1

Docking Scores:
-7.39 -7.48
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H1N1

Docking Scores:
-7.81 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H1N1

Docking Scores:
-8.75 -8.69
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H2N2

Docking Scores:
-7.18 -6.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H2N2

Docking Scores:
-7.84 -7.01
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H2N2

Docking Scores:
-8.04 -8.05
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H3N2

Docking Scores:
-6.76 -7.30 -6.56
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H3N2

Docking Scores:
-8.23 -8.29 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H3N2

Docking Scores:
-8.90 -8.56 -9.34
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H3N8

Docking Scores:
-6.55 -6.33 -6.47
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H3N8

Docking Scores:
-7.32 -7.63 -7.35
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H3N8

Docking Scores:
-7.58 -7.70 -8.26
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H5N1

Docking Scores:
-6.62 -7.29 -7.12
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H5N1

Docking Scores:
-8.51 -8.10 -8.04
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H5N1

Docking Scores:
-7.82 -7.45 -8.11
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H5N3

Docking Scores:
-7.56 -7.17
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H5N3

Docking Scores:
-7.27 -8.05
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H5N3

Docking Scores:
-7.63 -7.55
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H6N1

Docking Scores:
-7.07
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H6N1

Docking Scores:
-7.43
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H6N1

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

L: Saquinavir
HA_A-H6N6

Docking Scores:
-7.69
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H6N6

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

L: Paritaprevir
HA_A-H6N6

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

L: Saquinavir
HA_A-H7N2

Docking Scores:
-5.57 -6.40 -7.21
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H7N2

Docking Scores:
-7.41 -7.32 -7.29
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H7N2

Docking Scores:
-8.64 -7.63 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H7N7

Docking Scores:
-7.21 -8.03
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H7N7

Docking Scores:
-7.31 -8.91
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_A-H7N7

Docking Scores:
-7.90 -8.18
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_A-H7N9

Docking Scores:
-7.24
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_A-H7N9

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

L: Paritaprevir
HA_A-H7N9

Docking Scores:
-8.27
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_INFB

Docking Scores:
-7.43 -6.45
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_INFB

Docking Scores:
-7.97 -8.24
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HA_INFB

Docking Scores:
-8.70 -7.79
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HA_INFD

Docking Scores:
44.42
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HA_INFD

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

L: Paritaprevir
HA_INFD

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

L: Saquinavir
HE_BCV

Docking Scores:
-7.07 -7.09
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
HE_BCV

Docking Scores:
-8.44 -7.89
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
HE_BCV

Docking Scores:
-9.07 -7.98
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
HE_HCoV-OC43

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

L: Bictegravir
HE_HCoV-OC43

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

L: Paritaprevir
HE_HCoV-OC43

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

L: Saquinavir
HE_MHV

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

L: Bictegravir
HE_MHV

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

L: Paritaprevir
HE_MHV

Docking Scores:
-9.00
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
IN_HIV1

Docking Scores:
-6.09 -7.42
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
IN_HIV1

Docking Scores:
-6.27 -6.94
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
IN_HIV1

Docking Scores:
-7.61 -8.36
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
MD_HKU4

Docking Scores:
-10.20 -9.04 -9.75
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
MD_HKU4

Docking Scores:
-10.19 -10.05 -10.22
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
MD_HKU4

Docking Scores:
-8.00 -8.20 -8.59
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
MD_MERs

Docking Scores:
-10.42 -10.00
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
MD_MERs

Docking Scores:
-10.38 -10.08
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
MD_MERs

Docking Scores:
-9.12 -9.72
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
MX2_A-H5N1

Docking Scores:
10.59
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
MX2_A-H5N1

Docking Scores:
-9.98
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
MX2_A-H5N1

Docking Scores:
49.42
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H11N6

Docking Scores:
-8.75 -8.91 -8.67
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H11N6

Docking Scores:
-9.92 -9.55 -9.60
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H11N6

Docking Scores:
-8.91 -9.11 -9.43
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H11N9

Docking Scores:
-8.78 -10.03 -10.61
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H11N9

Docking Scores:
-8.21 -9.74 -9.42
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H11N9

Docking Scores:
-9.03 -10.42 -10.57
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H12N5

Docking Scores:
-9.87 -9.83 -8.58
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H12N5

Docking Scores:
-9.67 -9.61 -9.66
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H12N5

Docking Scores:
-9.58 -9.25 -10.01
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H13N9

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

L: Bictegravir
NA_A-H13N9

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

L: Paritaprevir
NA_A-H13N9

Docking Scores:
-8.26
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H17N10

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

L: Bictegravir
NA_A-H17N10

Docking Scores:
-9.24
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H17N10

Docking Scores:
-9.62
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H18N11

Docking Scores:
-7.43
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H18N11

Docking Scores:
-8.37
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H18N11

Docking Scores:
-9.36
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H1N1

Docking Scores:
-9.88
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H1N1

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

L: Paritaprevir
NA_A-H1N1

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

L: Saquinavir
NA_A-H2N2

Docking Scores:
-8.47 -9.46 -8.92
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H2N2

Docking Scores:
-8.68 -10.03 -9.34
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H2N2

Docking Scores:
-9.74 -10.52 -10.64
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H3N2

Docking Scores:
-9.17 -7.72
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H3N2

Docking Scores:
-9.29 -9.28
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H3N2

Docking Scores:
-9.33 -8.41
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H3N8

Docking Scores:
-9.09 -9.27 -9.80
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H3N8

Docking Scores:
-9.62 -9.33 -10.04
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H3N8

Docking Scores:
-9.92 -10.94 -10.11
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H5N1

Docking Scores:
-9.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H5N1

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

L: Paritaprevir
NA_A-H5N1

Docking Scores:
-9.68
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_A-H7N9

Docking Scores:
-10.11 -10.00 -9.78
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_A-H7N9

Docking Scores:
-9.64 -9.85 -9.61
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NA_A-H7N9

Docking Scores:
-10.54 -9.96 -10.23
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NA_INFB

Docking Scores:
-8.57 -8.64
Similarity Score:
38.74%
Best Match:
CHEMBL362993

L: Bictegravir
NA_INFB

Docking Scores:
-8.98 -8.55
Similarity Score:
31.12%
Best Match:
CHEMBL4175983

L: Paritaprevir
NA_INFB

Docking Scores:
-7.58 -7.37
Similarity Score:
39.83%
Best Match:
CHEMBL254679

L: Saquinavir
NP_A-H1N1

Docking Scores:
-7.08 -8.06 -7.36
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NP_A-H1N1

Docking Scores:
-7.87 -8.34 -8.75
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NP_A-H1N1

Docking Scores:
-7.73 -7.89 -8.01
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NP_A-H5N1

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

L: Bictegravir
NP_A-H5N1

Docking Scores:
-8.06
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NP_A-H5N1

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

L: Saquinavir
NP_HCoV-NL63

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

L: Bictegravir
NP_HCoV-NL63

Docking Scores:
-9.22
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NP_HCoV-NL63

Docking Scores:
-8.83
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NP_HCoV-OC43

Docking Scores:
-9.41 -7.91 -8.06
Similarity Score:
27.27%
Best Match:
CHEMBL3233481

L: Bictegravir
NP_HCoV-OC43

Docking Scores:
-11.95 -8.90 -8.08
Similarity Score:
15.54%
Best Match:
CHEMBL3233481

L: Paritaprevir
NP_HCoV-OC43

Docking Scores:
-10.45 -9.31 -8.84
Similarity Score:
16.54%
Best Match:
CHEMBL3233481

L: Saquinavir
NP_INFB

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

L: Bictegravir
NP_INFB

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

L: Paritaprevir
NP_INFB

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

L: Saquinavir
NP_INFD

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

L: Bictegravir
NP_INFD

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

L: Paritaprevir
NP_INFD

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

L: Saquinavir
NP_SARS

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

L: Bictegravir
NP_SARS

Docking Scores:
-9.04
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NP_SARS

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

L: Saquinavir
NS3_HCV1A

Docking Scores:
-8.26 -6.77 -7.22
Similarity Score:
54.12%
Best Match:
CHEMBL3645761

L: Bictegravir
NS3_HCV1A

Docking Scores:
-7.77 -7.76 -9.84
Similarity Score:
37.41%
Best Match:
CHEMBL3645743

L: Paritaprevir
NS3_HCV1A

Docking Scores:
-8.85 -8.17 -8.56
Similarity Score:
54.15%
Best Match:
CHEMBL3645617

L: Saquinavir
NS3_HCV1B

Docking Scores:
-9.29 -9.13 -6.79
Similarity Score:
50.00%
Best Match:
CHEMBL3954962

L: Bictegravir
NS3_HCV1B

Docking Scores:
-10.06 -10.79 -7.31
Similarity Score:
35.82%
Best Match:
CHEMBL3954962

L: Paritaprevir
NS3_HCV1B

Docking Scores:
-9.04 -8.71 -8.55
Similarity Score:
49.70%
Best Match:
CHEMBL297884

L: Saquinavir
NS3_HCV3A

Docking Scores:
-7.20 -6.55 -6.88
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS3_HCV3A

Docking Scores:
-9.34 -9.04 -7.87
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NS3_HCV3A

Docking Scores:
-8.78 -8.83 -9.12
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NS5B_HCV1A

Docking Scores:
-9.35 -10.52 -9.48
Similarity Score:
53.22%
Best Match:
CHEMBL13256

L: Bictegravir
NS5B_HCV1A

Docking Scores:
-10.61 -9.96 -10.18
Similarity Score:
36.11%
Best Match:
CHEMBL3644880

L: Paritaprevir
NS5B_HCV1A

Docking Scores:
-11.22 -11.31 -10.32
Similarity Score:
48.76%
Best Match:
CHEMBL3644934

L: Saquinavir
NS5B_HCV1B

Docking Scores:
-9.45 -9.30 -8.99
Similarity Score:
40.47%
Best Match:
CHEMBL3645202

L: Bictegravir
NS5B_HCV1B

Docking Scores:
-9.58 -9.62 -8.92
Similarity Score:
36.31%
Best Match:
CHEMBL3645214

L: Paritaprevir
NS5B_HCV1B

Docking Scores:
-10.71 -9.09 -8.62
Similarity Score:
39.44%
Best Match:
CHEMBL3645199

L: Saquinavir
NS5B_HCV2A

Docking Scores:
-11.35 -9.51
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS5B_HCV2A

Docking Scores:
-11.00 -10.69
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NS5B_HCV2A

Docking Scores:
-9.32 -5.12
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NSP15_SARS

Docking Scores:
-3.59
Similarity Score:
47.25%
Best Match:
CHEMBL2441745

L: Bictegravir
NSP15_SARS

Docking Scores:
-8.04
Similarity Score:
24.29%
Best Match:
CHEMBL2441745

L: Paritaprevir
NSP15_SARS

Docking Scores:
17.09
Similarity Score:
26.37%
Best Match:
CHEMBL2441741

L: Saquinavir
NSP1_INFB

Docking Scores:
-6.21 -6.97
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP1_INFB

Docking Scores:
-7.15 -7.45
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NSP1_INFB

Docking Scores:
-8.23 -8.87
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NSP1_SARS

Docking Scores:
-7.29
Similarity Score:
47.25%
Best Match:
CHEMBL2441745

L: Bictegravir
NSP1_SARS

Docking Scores:
-7.95
Similarity Score:
24.29%
Best Match:
CHEMBL2441745

L: Paritaprevir
NSP1_SARS

Docking Scores:
-2.21
Similarity Score:
26.37%
Best Match:
CHEMBL2441741

L: Saquinavir
NSP3_HCoV-229E

Docking Scores:
-10.99
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP3_HCoV-229E

Docking Scores:
-11.83
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NSP3_HCoV-229E

Docking Scores:
-10.48
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
NSP3_IBV

Docking Scores:
-9.25
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP3_IBV

Docking Scores:
-10.98
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NSP3_IBV

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

L: Saquinavir
NSP3_MHV

Docking Scores:
33.98
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP3_MHV

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

L: Paritaprevir
NSP3_MHV

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

L: Saquinavir
NSP9_HCoV-229E

Docking Scores:
-7.05 -6.83
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP9_HCoV-229E

Docking Scores:
-7.93 -8.26
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
NSP9_HCoV-229E

Docking Scores:
-7.20 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_A-H17N10

Docking Scores:
-7.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_A-H17N10

Docking Scores:
-9.52
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PA_A-H17N10

Docking Scores:
-10.35
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_A-H1N1

Docking Scores:
-10.93 -9.72 -9.35
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_A-H1N1

Docking Scores:
-10.75 -9.31 -10.06
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PA_A-H1N1

Docking Scores:
-9.89 -10.98 -10.54
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_A-H5N1

Docking Scores:
-9.73 -9.86 -9.93
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_A-H5N1

Docking Scores:
-10.31 -10.27 -10.01
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PA_A-H5N1

Docking Scores:
-11.43 -9.82 -10.72
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PA_INFA

Docking Scores:
-9.22 -8.55 -9.56
Similarity Score:
35.43%
Best Match:
CHEMBL463590

L: Bictegravir
PA_INFA

Docking Scores:
-11.03 -9.40 -9.72
Similarity Score:
30.00%
Best Match:
CHEMBL2040578

L: Paritaprevir
PA_INFA

Docking Scores:
-11.00 -10.12 -10.77
Similarity Score:
28.62%
Best Match:
CHEMBL2040640

L: Saquinavir
PA_INFB

Docking Scores:
-9.27
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_INFB

Docking Scores:
-9.27
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PA_INFB

Docking Scores:
-10.69
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PB2_A-H3N2

Docking Scores:
-9.77 -8.06
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PB2_A-H3N2

Docking Scores:
-9.42 -10.01
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB2_A-H3N2

Docking Scores:
-9.63 -8.95
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PB2_A-H5N1

Docking Scores:
-8.29 -7.95 -8.58
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PB2_A-H5N1

Docking Scores:
-7.99 -9.45 -9.20
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB2_A-H5N1

Docking Scores:
-8.57 -9.30 -10.03
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PB2_INFB

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

L: Bictegravir
PB2_INFB

Docking Scores:
-9.64
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB2_INFB

Docking Scores:
-10.12
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PB3_A-H3N2

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

L: Bictegravir
PB3_A-H3N2

Docking Scores:
-8.72
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB3_A-H3N2

Docking Scores:
-9.39
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PB4_A-H3N2

Docking Scores:
-9.38
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PB4_A-H3N2

Docking Scores:
-9.98
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PB4_A-H3N2

Docking Scores:
-9.38
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PLP_SARS

Docking Scores:
-9.13 -11.03 -11.05
Similarity Score:
36.79%
Best Match:
CHEMBL213054

L: Bictegravir
PLP_SARS

Docking Scores:
-10.77 -10.34 -10.68
Similarity Score:
29.32%
Best Match:
CHEMBL213054

L: Paritaprevir
PLP_SARS

Docking Scores:
-10.91 -8.75 -8.89
Similarity Score:
31.83%
Best Match:
CHEMBL212080

L: Saquinavir
PR_FCoV

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

L: Bictegravir
PR_FCoV

Docking Scores:
-9.64
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_FCoV

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

L: Saquinavir
PR_HCoV-229E

Docking Scores:
-8.25 -8.09
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HCoV-229E

Docking Scores:
-9.47 -8.63
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HCoV-229E

Docking Scores:
-8.69 -8.86
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_HCoV-NL63

Docking Scores:
-5.49 -8.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HCoV-NL63

Docking Scores:
-5.32 -9.41
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HCoV-NL63

Docking Scores:
-6.04 -10.07
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_HIV1

Docking Scores:
-7.62 -7.95 -7.93
Similarity Score:
31.65%
Best Match:
CHEMBL492666

L: Bictegravir
PR_HIV1

Docking Scores:
-8.39 -8.43 -7.97
Similarity Score:
25.83%
Best Match:
CHEMBL3645128

L: Paritaprevir
PR_HIV1

Docking Scores:
-8.17 -8.42 -8.13
Similarity Score:
28.62%
Best Match:
CHEMBL492666

L: Saquinavir
PR_HIV2

Docking Scores:
-7.61 -8.12
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HIV2

Docking Scores:
-8.90 -8.45
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HIV2

Docking Scores:
-8.94 -8.72
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_HKU1

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

L: Bictegravir
PR_HKU1

Docking Scores:
-8.52
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HKU1

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

L: Saquinavir
PR_HKU4

Docking Scores:
-8.57 -9.37 -8.03
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HKU4

Docking Scores:
-8.88 -8.73 -8.59
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_HKU4

Docking Scores:
-8.03 -8.63 -8.57
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_IBV

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

L: Bictegravir
PR_IBV

Docking Scores:
-9.50
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_IBV

Docking Scores:
-8.97
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_MERs

Docking Scores:
-9.43 -9.12
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_MERs

Docking Scores:
-8.92 -9.59
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_MERs

Docking Scores:
-7.94 -8.07
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_PEDV

Docking Scores:
-8.36
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_PEDV

Docking Scores:
-9.08
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_PEDV

Docking Scores:
-9.32
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_SARS

Docking Scores:
-8.83 -9.25 -8.27
Similarity Score:
47.25%
Best Match:
CHEMBL2441745

L: Bictegravir
PR_SARS

Docking Scores:
-9.79 -8.65 -8.88
Similarity Score:
24.29%
Best Match:
CHEMBL2441745

L: Paritaprevir
PR_SARS

Docking Scores:
-8.33 -8.44 -8.60
Similarity Score:
26.37%
Best Match:
CHEMBL2441741

L: Saquinavir
PR_SARS2

Docking Scores:
-9.04
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_SARS2

Docking Scores:
-9.47
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_SARS2

Docking Scores:
-9.16
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
PR_TGEV

Docking Scores:
-8.18
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_TGEV

Docking Scores:
-8.53
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
PR_TGEV

Docking Scores:
-8.36
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
RT_HIV1

Docking Scores:
-9.93 -10.18 -9.54
Similarity Score:
41.94%
Best Match:
CHEMBL4227326

L: Bictegravir
RT_HIV1

Docking Scores:
-11.02 -11.90 -10.85
Similarity Score:
30.95%
Best Match:
CHEMBL4109767

L: Paritaprevir
RT_HIV1

Docking Scores:
-10.58 -9.25 -9.57
Similarity Score:
37.04%
Best Match:
CHEMBL3977507

L: Saquinavir
SPIKE_HCoV-229E

Docking Scores:
-5.15
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
SPIKE_HCoV-229E

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

L: Paritaprevir
SPIKE_HCoV-229E

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

L: Saquinavir
SPIKE_HCoV-NL63

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

L: Bictegravir
SPIKE_HCoV-NL63

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

L: Paritaprevir
SPIKE_HCoV-NL63

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

L: Saquinavir
SPIKE_HCoV-OC43

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

L: Bictegravir
SPIKE_HCoV-OC43

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

L: Paritaprevir
SPIKE_HCoV-OC43

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

L: Saquinavir
SPIKE_HKU4

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

L: Bictegravir
SPIKE_HKU4

Docking Scores:
-8.33
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
SPIKE_HKU4

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

L: Saquinavir
SPIKE_IBV

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

L: Bictegravir
SPIKE_IBV

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

L: Paritaprevir
SPIKE_IBV

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

L: Saquinavir
SPIKE_MERs

Docking Scores:
-7.70 -7.10 -6.48
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
SPIKE_MERs

Docking Scores:
-8.52 -7.63 -7.41
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
SPIKE_MERs

Docking Scores:
-8.59 -9.09 -7.49
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
SPIKE_MHV

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

L: Bictegravir
SPIKE_MHV

Docking Scores:
-8.99
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
SPIKE_MHV

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

L: Saquinavir
SPIKE_PDCoV

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

L: Bictegravir
SPIKE_PDCoV

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

L: Paritaprevir
SPIKE_PDCoV

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

L: Saquinavir
SPIKE_SARS

Docking Scores:
-6.33 -6.25
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
SPIKE_SARS

Docking Scores:
-7.85 -7.69
Similarity Score:
N/A
Best Match:
N/A

L: Paritaprevir
SPIKE_SARS

Docking Scores:
-8.27 -8.35
Similarity Score:
N/A
Best Match:
N/A

L: Saquinavir
SPIKE_SARS2

Docking Scores:
-5.73
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
SPIKE_SARS2

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

L: Paritaprevir
SPIKE_SARS2

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