LTJv7 #83 Output Download CSV

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

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

L: Darunavir
GP160_HIV1

Docking Scores:
-7.52 -7.92 -5.73
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
GP160_HIV1

Docking Scores:
-7.91 -7.32 -7.60
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
GP160_HIV1

Docking Scores:
-7.59 -8.56 -8.60
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
GP160_HIV1

Docking Scores:
-7.10 -6.68 -6.81
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: Darunavir
GP160_HIV2

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

L: Baloxavir marboxil
GP160_HIV2

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

L: Simeprevir
GP160_HIV2

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

L: Adefovir dipivoxil
GP160_HIV2

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

L: Bictegravir
GP_EBOV

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

L: Darunavir
GP_EBOV

Docking Scores:
-7.96 -7.64 -7.80
Similarity Score:
29.13%
Best Match:
CHEMBL3125899

L: Baloxavir marboxil
GP_EBOV

Docking Scores:
-7.36 -6.63 -7.64
Similarity Score:
25.89%
Best Match:
CHEMBL3125895

L: Simeprevir
GP_EBOV

Docking Scores:
-9.40 -8.37 -8.23
Similarity Score:
39.60%
Best Match:
CHEMBL3125899

L: Adefovir dipivoxil
GP_EBOV

Docking Scores:
-6.69 -6.63 -6.49
Similarity Score:
15.44%
Best Match:
CHEMBL3125895

L: Bictegravir
HA_A-H10N7

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

L: Darunavir
HA_A-H10N7

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

L: Baloxavir marboxil
HA_A-H10N7

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

L: Simeprevir
HA_A-H10N7

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

L: Adefovir dipivoxil
HA_A-H10N7

Docking Scores:
-5.59
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: Darunavir
HA_A-H10N8

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

L: Baloxavir marboxil
HA_A-H10N8

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

L: Simeprevir
HA_A-H10N8

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

L: Adefovir dipivoxil
HA_A-H10N8

Docking Scores:
-5.80
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: Darunavir
HA_A-H13N6

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

L: Baloxavir marboxil
HA_A-H13N6

Docking Scores:
24.13
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H13N6

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

L: Adefovir dipivoxil
HA_A-H13N6

Docking Scores:
1.69
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: Darunavir
HA_A-H14N6

Docking Scores:
-6.91
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H14N6

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

L: Simeprevir
HA_A-H14N6

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

L: Adefovir dipivoxil
HA_A-H14N6

Docking Scores:
-6.12
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: Darunavir
HA_A-H15N9

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

L: Baloxavir marboxil
HA_A-H15N9

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

L: Simeprevir
HA_A-H15N9

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

L: Adefovir dipivoxil
HA_A-H15N9

Docking Scores:
-6.00
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: Darunavir
HA_A-H17N10

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

L: Baloxavir marboxil
HA_A-H17N10

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

L: Simeprevir
HA_A-H17N10

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

L: Adefovir dipivoxil
HA_A-H17N10

Docking Scores:
-4.89
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: Darunavir
HA_A-H18N11

Docking Scores:
-5.91
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H18N11

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

L: Simeprevir
HA_A-H18N11

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

L: Adefovir dipivoxil
HA_A-H18N11

Docking Scores:
-5.12
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: Darunavir
HA_A-H1N1

Docking Scores:
-6.44 -6.43
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H1N1

Docking Scores:
-7.46 -7.51
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H1N1

Docking Scores:
-7.53 -7.64
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H1N1

Docking Scores:
-5.94 -5.87
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: Darunavir
HA_A-H2N2

Docking Scores:
-6.20 -5.66
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H2N2

Docking Scores:
-6.66 -7.62
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H2N2

Docking Scores:
-7.86 -7.43
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H2N2

Docking Scores:
-4.98 -5.58
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: Darunavir
HA_A-H3N2

Docking Scores:
-6.65 -6.22 -6.72
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H3N2

Docking Scores:
-6.94 -6.90 -7.19
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H3N2

Docking Scores:
-7.90 -7.64 -7.89
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H3N2

Docking Scores:
-5.26 -5.33 -5.73
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: Darunavir
HA_A-H3N8

Docking Scores:
-5.59 -5.96 -5.84
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H3N8

Docking Scores:
-6.48 -6.76 -6.85
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H3N8

Docking Scores:
-7.64 -7.45 -7.04
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H3N8

Docking Scores:
-5.45 -5.09 -5.51
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: Darunavir
HA_A-H5N1

Docking Scores:
-6.82 -6.14 -6.09
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H5N1

Docking Scores:
-6.90 -7.48 -7.16
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H5N1

Docking Scores:
-8.39 -7.79 -7.96
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H5N1

Docking Scores:
-5.32 -5.87 -5.82
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: Darunavir
HA_A-H5N3

Docking Scores:
-6.14 -6.76
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H5N3

Docking Scores:
-7.42 -7.05
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H5N3

Docking Scores:
-7.84 -7.98
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H5N3

Docking Scores:
-5.69 -5.30
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: Darunavir
HA_A-H6N1

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

L: Baloxavir marboxil
HA_A-H6N1

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

L: Simeprevir
HA_A-H6N1

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

L: Adefovir dipivoxil
HA_A-H6N1

Docking Scores:
-5.80
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: Darunavir
HA_A-H6N6

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

L: Baloxavir marboxil
HA_A-H6N6

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

L: Simeprevir
HA_A-H6N6

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

L: Adefovir dipivoxil
HA_A-H6N6

Docking Scores:
-5.76
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: Darunavir
HA_A-H7N2

Docking Scores:
-6.31 -6.11 -6.70
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H7N2

Docking Scores:
-6.94 -7.11 -6.84
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H7N2

Docking Scores:
-7.97 -8.04 -7.33
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H7N2

Docking Scores:
-5.53 -5.90 -6.14
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: Darunavir
HA_A-H7N7

Docking Scores:
-6.28 -7.19
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_A-H7N7

Docking Scores:
-6.98 -8.30
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_A-H7N7

Docking Scores:
-8.38 -8.23
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H7N7

Docking Scores:
-5.47 -6.03
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: Darunavir
HA_A-H7N9

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

L: Baloxavir marboxil
HA_A-H7N9

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

L: Simeprevir
HA_A-H7N9

Docking Scores:
-7.71
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_A-H7N9

Docking Scores:
-5.73
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: Darunavir
HA_INFB

Docking Scores:
-7.00 -6.34
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_INFB

Docking Scores:
-7.23 -7.05
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_INFB

Docking Scores:
-8.35 -8.09
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HA_INFB

Docking Scores:
-5.60 -5.98
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: Darunavir
HA_INFD

Docking Scores:
0.58
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HA_INFD

Docking Scores:
0.81
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HA_INFD

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

L: Adefovir dipivoxil
HA_INFD

Docking Scores:
-2.09
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: Darunavir
HE_BCV

Docking Scores:
-7.11 -6.13
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
HE_BCV

Docking Scores:
-7.29 -7.34
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
HE_BCV

Docking Scores:
-8.53 -7.93
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
HE_BCV

Docking Scores:
-5.55 -5.59
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: Darunavir
HE_HCoV-OC43

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

L: Baloxavir marboxil
HE_HCoV-OC43

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

L: Simeprevir
HE_HCoV-OC43

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

L: Adefovir dipivoxil
HE_HCoV-OC43

Docking Scores:
-5.11
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: Darunavir
HE_MHV

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

L: Baloxavir marboxil
HE_MHV

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

L: Simeprevir
HE_MHV

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

L: Adefovir dipivoxil
HE_MHV

Docking Scores:
-5.24
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: Darunavir
IN_HIV1

Docking Scores:
-5.92 -6.28
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
IN_HIV1

Docking Scores:
-6.17 -5.96
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
IN_HIV1

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

L: Adefovir dipivoxil
IN_HIV1

Docking Scores:
-4.93 -4.91
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: Darunavir
MD_HKU4

Docking Scores:
-8.45 -8.03 -7.83
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
MD_HKU4

Docking Scores:
-7.57 -6.90 -7.11
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
MD_HKU4

Docking Scores:
-8.97 -9.35 -8.89
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
MD_HKU4

Docking Scores:
-8.43 -7.24 -7.89
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: Darunavir
MD_MERs

Docking Scores:
-8.39 -8.69
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
MD_MERs

Docking Scores:
-8.11 -8.35
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
MD_MERs

Docking Scores:
-9.43 -9.99
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
MD_MERs

Docking Scores:
-8.52 -7.89
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: Darunavir
MX2_A-H5N1

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

L: Baloxavir marboxil
MX2_A-H5N1

Docking Scores:
3.74
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
MX2_A-H5N1

Docking Scores:
33.15
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
MX2_A-H5N1

Docking Scores:
-5.98
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: Darunavir
NA_A-H11N6

Docking Scores:
-8.31 -8.58 -7.38
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H11N6

Docking Scores:
-7.59 -7.57 -7.60
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H11N6

Docking Scores:
-9.25 -9.06 -8.78
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H11N6

Docking Scores:
-7.28 -7.22 -7.10
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: Darunavir
NA_A-H11N9

Docking Scores:
-7.13 -8.12 -7.37
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H11N9

Docking Scores:
-7.75 -8.06 -8.01
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H11N9

Docking Scores:
-6.93 -8.91 -9.06
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H11N9

Docking Scores:
-6.80 -6.90 -7.18
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: Darunavir
NA_A-H12N5

Docking Scores:
-8.07 -8.12 -8.00
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H12N5

Docking Scores:
-9.43 -7.51 -6.93
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H12N5

Docking Scores:
-9.11 -9.35 -9.31
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H12N5

Docking Scores:
-7.19 -7.17 -6.81
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: Darunavir
NA_A-H13N9

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

L: Baloxavir marboxil
NA_A-H13N9

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

L: Simeprevir
NA_A-H13N9

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

L: Adefovir dipivoxil
NA_A-H13N9

Docking Scores:
-5.27
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: Darunavir
NA_A-H17N10

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

L: Baloxavir marboxil
NA_A-H17N10

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

L: Simeprevir
NA_A-H17N10

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

L: Adefovir dipivoxil
NA_A-H17N10

Docking Scores:
-6.59
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: Darunavir
NA_A-H18N11

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

L: Baloxavir marboxil
NA_A-H18N11

Docking Scores:
-8.32
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H18N11

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

L: Adefovir dipivoxil
NA_A-H18N11

Docking Scores:
-6.29
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: Darunavir
NA_A-H1N1

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

L: Baloxavir marboxil
NA_A-H1N1

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

L: Simeprevir
NA_A-H1N1

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

L: Adefovir dipivoxil
NA_A-H1N1

Docking Scores:
-7.22
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: Darunavir
NA_A-H2N2

Docking Scores:
-7.67 -7.69 -7.81
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H2N2

Docking Scores:
-7.95 -8.75 -7.74
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H2N2

Docking Scores:
-8.98 -9.90 -9.59
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H2N2

Docking Scores:
-7.05 -7.41 -7.31
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: Darunavir
NA_A-H3N2

Docking Scores:
-7.29 -7.33
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H3N2

Docking Scores:
-8.08 -7.33
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H3N2

Docking Scores:
-9.40 -8.37
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H3N2

Docking Scores:
-7.11 -6.62
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: Darunavir
NA_A-H3N8

Docking Scores:
-7.56 -8.63 -7.54
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H3N8

Docking Scores:
-7.47 -9.29 -9.70
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H3N8

Docking Scores:
-9.30 -8.87 -9.42
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H3N8

Docking Scores:
-7.14 -7.75 -7.69
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: Darunavir
NA_A-H5N1

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

L: Baloxavir marboxil
NA_A-H5N1

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

L: Simeprevir
NA_A-H5N1

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

L: Adefovir dipivoxil
NA_A-H5N1

Docking Scores:
-7.98
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: Darunavir
NA_A-H7N9

Docking Scores:
-7.74 -8.21 -8.30
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NA_A-H7N9

Docking Scores:
-8.04 -7.72 -7.81
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NA_A-H7N9

Docking Scores:
-8.73 -9.24 -9.10
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NA_A-H7N9

Docking Scores:
-7.22 -7.35 -7.09
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NA_INFB

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

L: Darunavir
NA_INFB

Docking Scores:
-7.99 -8.19
Similarity Score:
29.03%
Best Match:
CHEMBL348066

L: Baloxavir marboxil
NA_INFB

Docking Scores:
-7.35 -7.82
Similarity Score:
21.78%
Best Match:
CHEMBL4175983

L: Simeprevir
NA_INFB

Docking Scores:
-8.26 -8.28
Similarity Score:
35.05%
Best Match:
CHEMBL4161935

L: Adefovir dipivoxil
NA_INFB

Docking Scores:
-6.63 -6.99
Similarity Score:
18.33%
Best Match:
CHEMBL183817

L: Bictegravir
NP_A-H1N1

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

L: Darunavir
NP_A-H1N1

Docking Scores:
-5.91 -8.09 -6.06
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NP_A-H1N1

Docking Scores:
-6.58 -6.15 -6.68
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NP_A-H1N1

Docking Scores:
-6.83 -7.84 -8.19
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NP_A-H1N1

Docking Scores:
-4.72 -6.01 -5.54
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: Darunavir
NP_A-H5N1

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

L: Baloxavir marboxil
NP_A-H5N1

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

L: Simeprevir
NP_A-H5N1

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

L: Adefovir dipivoxil
NP_A-H5N1

Docking Scores:
-5.36
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: Darunavir
NP_HCoV-NL63

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

L: Baloxavir marboxil
NP_HCoV-NL63

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

L: Simeprevir
NP_HCoV-NL63

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

L: Adefovir dipivoxil
NP_HCoV-NL63

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

L: Bictegravir
NP_HCoV-OC43

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

L: Darunavir
NP_HCoV-OC43

Docking Scores:
-7.30 -7.43 -7.13
Similarity Score:
12.32%
Best Match:
CHEMBL3233481

L: Baloxavir marboxil
NP_HCoV-OC43

Docking Scores:
-8.11 -7.40 -7.37
Similarity Score:
13.71%
Best Match:
CHEMBL3233481

L: Simeprevir
NP_HCoV-OC43

Docking Scores:
-8.91 -8.09 -8.36
Similarity Score:
13.45%
Best Match:
CHEMBL3233481

L: Adefovir dipivoxil
NP_HCoV-OC43

Docking Scores:
-6.70 -5.61 -6.07
Similarity Score:
9.94%
Best Match:
CHEMBL3233481

L: Bictegravir
NP_INFB

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

L: Darunavir
NP_INFB

Docking Scores:
-5.62
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NP_INFB

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

L: Simeprevir
NP_INFB

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

L: Adefovir dipivoxil
NP_INFB

Docking Scores:
-5.23
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: Darunavir
NP_INFD

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

L: Baloxavir marboxil
NP_INFD

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

L: Simeprevir
NP_INFD

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

L: Adefovir dipivoxil
NP_INFD

Docking Scores:
-4.95
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: Darunavir
NP_SARS

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

L: Baloxavir marboxil
NP_SARS

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

L: Simeprevir
NP_SARS

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

L: Adefovir dipivoxil
NP_SARS

Docking Scores:
-6.41
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS3_HCV1A

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

L: Darunavir
NS3_HCV1A

Docking Scores:
-5.68 -6.08 -6.69
Similarity Score:
27.85%
Best Match:
CHEMBL3639445

L: Baloxavir marboxil
NS3_HCV1A

Docking Scores:
-7.22 -7.01 -6.56
Similarity Score:
33.49%
Best Match:
CHEMBL3896463

L: Simeprevir
NS3_HCV1A

Docking Scores:
-8.65 -6.74 -7.62
Similarity Score:
41.64%
Best Match:
CHEMBL3645743

L: Adefovir dipivoxil
NS3_HCV1A

Docking Scores:
-5.68 -5.23 -5.95
Similarity Score:
33.62%
Best Match:
CHEMBL3696817

L: Bictegravir
NS3_HCV1B

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

L: Darunavir
NS3_HCV1B

Docking Scores:
-8.90 -7.16 -6.11
Similarity Score:
36.30%
Best Match:
CHEMBL1170417

L: Baloxavir marboxil
NS3_HCV1B

Docking Scores:
-6.99 -6.96 -7.00
Similarity Score:
25.95%
Best Match:
CHEMBL1170417

L: Simeprevir
NS3_HCV1B

Docking Scores:
-7.46 -7.85 -7.56
Similarity Score:
53.64%
Best Match:
CHEMBL297884

L: Adefovir dipivoxil
NS3_HCV1B

Docking Scores:
-6.25 -6.86 -5.68
Similarity Score:
17.13%
Best Match:
CHEMBL3125634

L: Bictegravir
NS3_HCV3A

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

L: Darunavir
NS3_HCV3A

Docking Scores:
-7.20 -7.25 -6.96
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NS3_HCV3A

Docking Scores:
-7.48 -7.49 -7.05
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NS3_HCV3A

Docking Scores:
-7.27 -8.68 -7.68
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NS3_HCV3A

Docking Scores:
-6.57 -6.42 -6.53
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NS5B_HCV1A

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

L: Darunavir
NS5B_HCV1A

Docking Scores:
-8.15 -8.55 -9.28
Similarity Score:
42.02%
Best Match:
CHEMBL3644924

L: Baloxavir marboxil
NS5B_HCV1A

Docking Scores:
-9.33 -8.87 -9.22
Similarity Score:
26.10%
Best Match:
CHEMBL353549

L: Simeprevir
NS5B_HCV1A

Docking Scores:
-11.63 -10.70 -10.62
Similarity Score:
42.12%
Best Match:
CHEMBL3644920

L: Adefovir dipivoxil
NS5B_HCV1A

Docking Scores:
-6.57 -8.33 -8.17
Similarity Score:
22.31%
Best Match:
CHEMBL353549

L: Bictegravir
NS5B_HCV1B

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

L: Darunavir
NS5B_HCV1B

Docking Scores:
-8.06 -8.35 -8.06
Similarity Score:
35.40%
Best Match:
CHEMBL3645211

L: Baloxavir marboxil
NS5B_HCV1B

Docking Scores:
-7.59 -7.06 -7.91
Similarity Score:
32.79%
Best Match:
CHEMBL3645182

L: Simeprevir
NS5B_HCV1B

Docking Scores:
-8.77 -9.44 -8.20
Similarity Score:
36.98%
Best Match:
CHEMBL3645202

L: Adefovir dipivoxil
NS5B_HCV1B

Docking Scores:
-6.64 -6.76 -6.17
Similarity Score:
22.94%
Best Match:
CHEMBL3970609

L: Bictegravir
NS5B_HCV2A

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

L: Darunavir
NS5B_HCV2A

Docking Scores:
-9.43 -8.70
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NS5B_HCV2A

Docking Scores:
-8.92 -5.96
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NS5B_HCV2A

Docking Scores:
-9.63 -5.07
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NS5B_HCV2A

Docking Scores:
-8.05 -8.22
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP15_SARS

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

L: Darunavir
NSP15_SARS

Docking Scores:
-5.62
Similarity Score:
34.91%
Best Match:
CHEMBL2441745

L: Baloxavir marboxil
NSP15_SARS

Docking Scores:
-6.51
Similarity Score:
20.36%
Best Match:
CHEMBL3105073

L: Simeprevir
NSP15_SARS

Docking Scores:
4.45
Similarity Score:
25.42%
Best Match:
CHEMBL2441745

L: Adefovir dipivoxil
NSP15_SARS

Docking Scores:
-5.51
Similarity Score:
15.05%
Best Match:
CHEMBL2441741

L: Bictegravir
NSP1_INFB

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

L: Darunavir
NSP1_INFB

Docking Scores:
-6.71 -6.76
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NSP1_INFB

Docking Scores:
-6.74 -6.61
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NSP1_INFB

Docking Scores:
-7.38 -7.55
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NSP1_INFB

Docking Scores:
-5.30 -5.28
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
NSP1_SARS

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

L: Darunavir
NSP1_SARS

Docking Scores:
-6.03
Similarity Score:
34.91%
Best Match:
CHEMBL2441745

L: Baloxavir marboxil
NSP1_SARS

Docking Scores:
-5.11
Similarity Score:
20.36%
Best Match:
CHEMBL3105073

L: Simeprevir
NSP1_SARS

Docking Scores:
-5.92
Similarity Score:
25.42%
Best Match:
CHEMBL2441745

L: Adefovir dipivoxil
NSP1_SARS

Docking Scores:
-5.85
Similarity Score:
15.05%
Best Match:
CHEMBL2441741

L: Bictegravir
NSP3_HCoV-229E

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

L: Darunavir
NSP3_HCoV-229E

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

L: Baloxavir marboxil
NSP3_HCoV-229E

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

L: Simeprevir
NSP3_HCoV-229E

Docking Scores:
-9.81
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NSP3_HCoV-229E

Docking Scores:
-7.51
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: Darunavir
NSP3_IBV

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

L: Baloxavir marboxil
NSP3_IBV

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

L: Simeprevir
NSP3_IBV

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

L: Adefovir dipivoxil
NSP3_IBV

Docking Scores:
-6.88
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: Darunavir
NSP3_MHV

Docking Scores:
-2.60
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NSP3_MHV

Docking Scores:
-1.05
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NSP3_MHV

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

L: Adefovir dipivoxil
NSP3_MHV

Docking Scores:
-3.22
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: Darunavir
NSP9_HCoV-229E

Docking Scores:
-6.60 -6.34
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
NSP9_HCoV-229E

Docking Scores:
-7.17 -6.78
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
NSP9_HCoV-229E

Docking Scores:
-6.93 -6.05
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
NSP9_HCoV-229E

Docking Scores:
-5.59 -5.59
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: Darunavir
PA_A-H17N10

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

L: Baloxavir marboxil
PA_A-H17N10

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

L: Simeprevir
PA_A-H17N10

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

L: Adefovir dipivoxil
PA_A-H17N10

Docking Scores:
-6.64
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: Darunavir
PA_A-H1N1

Docking Scores:
-8.96 -7.71 -7.86
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PA_A-H1N1

Docking Scores:
-9.14 -8.92 -8.64
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PA_A-H1N1

Docking Scores:
-8.98 -9.63 -10.12
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PA_A-H1N1

Docking Scores:
-7.68 -6.96 -6.94
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: Darunavir
PA_A-H5N1

Docking Scores:
-7.77 -7.56 -7.85
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PA_A-H5N1

Docking Scores:
-9.68 -9.27 -9.37
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PA_A-H5N1

Docking Scores:
-10.31 -9.84 -10.35
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PA_A-H5N1

Docking Scores:
-6.92 -6.82 -6.90
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PA_INFA

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

L: Darunavir
PA_INFA

Docking Scores:
-8.61 -7.10 -7.84
Similarity Score:
28.70%
Best Match:
CHEMBL2040640

L: Baloxavir marboxil
PA_INFA

Docking Scores:
-8.72 -8.79 -9.05
Similarity Score:
26.71%
Best Match:
CHEMBL2040578

L: Simeprevir
PA_INFA

Docking Scores:
-10.09 -9.25 -9.77
Similarity Score:
32.87%
Best Match:
CHEMBL2040640

L: Adefovir dipivoxil
PA_INFA

Docking Scores:
-7.44 -6.83 -7.16
Similarity Score:
17.52%
Best Match:
CHEMBL2040578

L: Bictegravir
PA_INFB

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

L: Darunavir
PA_INFB

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

L: Baloxavir marboxil
PA_INFB

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

L: Simeprevir
PA_INFB

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

L: Adefovir dipivoxil
PA_INFB

Docking Scores:
-6.86
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: Darunavir
PB2_A-H3N2

Docking Scores:
-8.03 -8.12
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PB2_A-H3N2

Docking Scores:
-8.92 -8.43
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PB2_A-H3N2

Docking Scores:
-8.81 -8.94
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PB2_A-H3N2

Docking Scores:
-6.70 -6.25
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: Darunavir
PB2_A-H5N1

Docking Scores:
-7.43 -6.76 -7.91
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PB2_A-H5N1

Docking Scores:
-7.98 -7.60 -7.48
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PB2_A-H5N1

Docking Scores:
-8.46 -8.41 -9.01
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PB2_A-H5N1

Docking Scores:
-5.98 -6.04 -6.05
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: Darunavir
PB2_INFB

Docking Scores:
-7.66
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PB2_INFB

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

L: Simeprevir
PB2_INFB

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

L: Adefovir dipivoxil
PB2_INFB

Docking Scores:
-6.25
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: Darunavir
PB3_A-H3N2

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

L: Baloxavir marboxil
PB3_A-H3N2

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

L: Simeprevir
PB3_A-H3N2

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

L: Adefovir dipivoxil
PB3_A-H3N2

Docking Scores:
-6.16
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: Darunavir
PB4_A-H3N2

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

L: Baloxavir marboxil
PB4_A-H3N2

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PB4_A-H3N2

Docking Scores:
-9.53
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PB4_A-H3N2

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

L: Bictegravir
PLP_SARS

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

L: Darunavir
PLP_SARS

Docking Scores:
-8.69 -9.03 -9.68
Similarity Score:
28.77%
Best Match:
CHEMBL213054

L: Baloxavir marboxil
PLP_SARS

Docking Scores:
-7.18 -7.24 -9.43
Similarity Score:
22.13%
Best Match:
CHEMBL190743

L: Simeprevir
PLP_SARS

Docking Scores:
-9.56 -10.25 -10.54
Similarity Score:
30.10%
Best Match:
CHEMBL213543

L: Adefovir dipivoxil
PLP_SARS

Docking Scores:
-7.68 -7.39 -8.00
Similarity Score:
16.91%
Best Match:
CHEMBL213054

L: Bictegravir
PR_FCoV

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

L: Darunavir
PR_FCoV

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

L: Baloxavir marboxil
PR_FCoV

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

L: Simeprevir
PR_FCoV

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

L: Adefovir dipivoxil
PR_FCoV

Docking Scores:
-6.51
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: Darunavir
PR_HCoV-229E

Docking Scores:
-7.20 -6.83
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_HCoV-229E

Docking Scores:
-7.92 -7.86
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PR_HCoV-229E

Docking Scores:
-7.63 -7.94
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PR_HCoV-229E

Docking Scores:
-6.92 -6.46
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: Darunavir
PR_HCoV-NL63

Docking Scores:
-5.12 -8.03
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_HCoV-NL63

Docking Scores:
-4.81 -7.95
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PR_HCoV-NL63

Docking Scores:
-5.51 -9.05
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PR_HCoV-NL63

Docking Scores:
-4.22 -6.60
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
PR_HIV1

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

L: Darunavir
PR_HIV1

Docking Scores:
-7.00 -6.68 -6.43
Similarity Score:
84.97%
Best Match:
CHEMBL467420

L: Baloxavir marboxil
PR_HIV1

Docking Scores:
-7.50 -7.10 -7.30
Similarity Score:
22.29%
Best Match:
CHEMBL450294

L: Simeprevir
PR_HIV1

Docking Scores:
-8.21 -7.90 -8.38
Similarity Score:
25.89%
Best Match:
CHEMBL492666

L: Adefovir dipivoxil
PR_HIV1

Docking Scores:
-5.49 -5.59 -5.37
Similarity Score:
17.95%
Best Match:
CHEMBL3645129

L: Bictegravir
PR_HIV2

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

L: Darunavir
PR_HIV2

Docking Scores:
-7.27 -7.10
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_HIV2

Docking Scores:
-8.08 -6.61
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PR_HIV2

Docking Scores:
-8.32 -7.93
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PR_HIV2

Docking Scores:
-5.77 -5.70
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: Darunavir
PR_HKU1

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

L: Baloxavir marboxil
PR_HKU1

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

L: Simeprevir
PR_HKU1

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

L: Adefovir dipivoxil
PR_HKU1

Docking Scores:
-6.20
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: Darunavir
PR_HKU4

Docking Scores:
-7.86 -6.98 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_HKU4

Docking Scores:
-8.01 -6.76 -7.67
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PR_HKU4

Docking Scores:
-8.21 -7.93 -7.63
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PR_HKU4

Docking Scores:
-6.55 -6.31 -6.49
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: Darunavir
PR_IBV

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

L: Baloxavir marboxil
PR_IBV

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

L: Simeprevir
PR_IBV

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

L: Adefovir dipivoxil
PR_IBV

Docking Scores:
-6.51
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: Darunavir
PR_MERs

Docking Scores:
-7.87 -7.30
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_MERs

Docking Scores:
-7.42 -7.69
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
PR_MERs

Docking Scores:
-8.75 -8.06
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
PR_MERs

Docking Scores:
-6.46 -6.69
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: Darunavir
PR_PEDV

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

L: Baloxavir marboxil
PR_PEDV

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

L: Simeprevir
PR_PEDV

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

L: Adefovir dipivoxil
PR_PEDV

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

L: Bictegravir
PR_SARS

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

L: Darunavir
PR_SARS

Docking Scores:
-7.49 -7.15 -7.57
Similarity Score:
34.91%
Best Match:
CHEMBL2441745

L: Baloxavir marboxil
PR_SARS

Docking Scores:
-7.66 -7.85 -7.10
Similarity Score:
20.36%
Best Match:
CHEMBL3105073

L: Simeprevir
PR_SARS

Docking Scores:
-7.99 -7.90 -8.72
Similarity Score:
25.42%
Best Match:
CHEMBL2441745

L: Adefovir dipivoxil
PR_SARS

Docking Scores:
-6.49 -6.80 -6.35
Similarity Score:
15.05%
Best Match:
CHEMBL2441741

L: Bictegravir
PR_SARS2

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

L: Darunavir
PR_SARS2

Docking Scores:
-7.71
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
PR_SARS2

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

L: Simeprevir
PR_SARS2

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

L: Adefovir dipivoxil
PR_SARS2

Docking Scores:
-6.74
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: Darunavir
PR_TGEV

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

L: Baloxavir marboxil
PR_TGEV

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

L: Simeprevir
PR_TGEV

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

L: Adefovir dipivoxil
PR_TGEV

Docking Scores:
-6.32
Similarity Score:
N/A
Best Match:
N/A

L: Bictegravir
RT_HIV1

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

L: Darunavir
RT_HIV1

Docking Scores:
-9.41 -8.97 -9.72
Similarity Score:
55.50%
Best Match:
CHEMBL3683710

L: Baloxavir marboxil
RT_HIV1

Docking Scores:
-7.26 -6.55 -5.75
Similarity Score:
31.09%
Best Match:
CHEMBL4108135

L: Simeprevir
RT_HIV1

Docking Scores:
-9.12 -7.38 -8.15
Similarity Score:
37.08%
Best Match:
CHEMBL3683705

L: Adefovir dipivoxil
RT_HIV1

Docking Scores:
-7.10 -7.96 -7.41
Similarity Score:
25.38%
Best Match:
CHEMBL4288759

L: Bictegravir
SPIKE_HCoV-229E

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

L: Darunavir
SPIKE_HCoV-229E

Docking Scores:
-5.23
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
SPIKE_HCoV-229E

Docking Scores:
-5.75
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
SPIKE_HCoV-229E

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

L: Adefovir dipivoxil
SPIKE_HCoV-229E

Docking Scores:
-4.80
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: Darunavir
SPIKE_HCoV-NL63

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

L: Baloxavir marboxil
SPIKE_HCoV-NL63

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

L: Simeprevir
SPIKE_HCoV-NL63

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

L: Adefovir dipivoxil
SPIKE_HCoV-NL63

Docking Scores:
-5.05
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: Darunavir
SPIKE_HCoV-OC43

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

L: Baloxavir marboxil
SPIKE_HCoV-OC43

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

L: Simeprevir
SPIKE_HCoV-OC43

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

L: Adefovir dipivoxil
SPIKE_HCoV-OC43

Docking Scores:
-5.85
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: Darunavir
SPIKE_HKU4

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

L: Baloxavir marboxil
SPIKE_HKU4

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

L: Simeprevir
SPIKE_HKU4

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

L: Adefovir dipivoxil
SPIKE_HKU4

Docking Scores:
-6.08
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: Darunavir
SPIKE_IBV

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

L: Baloxavir marboxil
SPIKE_IBV

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

L: Simeprevir
SPIKE_IBV

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

L: Adefovir dipivoxil
SPIKE_IBV

Docking Scores:
-5.80
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: Darunavir
SPIKE_MERs

Docking Scores:
-7.21 -7.05 -5.17
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
SPIKE_MERs

Docking Scores:
-7.65 -7.21 -6.64
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
SPIKE_MERs

Docking Scores:
-8.15 -8.10 -7.01
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
SPIKE_MERs

Docking Scores:
-5.82 -5.57 -5.07
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: Darunavir
SPIKE_MHV

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

L: Baloxavir marboxil
SPIKE_MHV

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

L: Simeprevir
SPIKE_MHV

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

L: Adefovir dipivoxil
SPIKE_MHV

Docking Scores:
-6.15
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: Darunavir
SPIKE_PDCoV

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

L: Baloxavir marboxil
SPIKE_PDCoV

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

L: Simeprevir
SPIKE_PDCoV

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

L: Adefovir dipivoxil
SPIKE_PDCoV

Docking Scores:
-5.72
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: Darunavir
SPIKE_SARS

Docking Scores:
-6.01 -6.39
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
SPIKE_SARS

Docking Scores:
-6.83 -6.93
Similarity Score:
N/A
Best Match:
N/A

L: Simeprevir
SPIKE_SARS

Docking Scores:
-7.60 -7.20
Similarity Score:
N/A
Best Match:
N/A

L: Adefovir dipivoxil
SPIKE_SARS

Docking Scores:
-5.16 -5.81
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: Darunavir
SPIKE_SARS2

Docking Scores:
-4.98
Similarity Score:
N/A
Best Match:
N/A

L: Baloxavir marboxil
SPIKE_SARS2

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

L: Simeprevir
SPIKE_SARS2

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

L: Adefovir dipivoxil
SPIKE_SARS2

Docking Scores:
-5.50
Similarity Score:
N/A
Best Match:
N/A