wep #354 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACE2_HUMAN

Docking Scores:
-10.62
Similarity Score:
21.05%
Best Match:
CHEMBL254900

GP160_HIV1

Docking Scores:
-7.35 -7.50 -7.78
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-7.61 -7.44 -7.36
Similarity Score:
35.14%
Best Match:
CHEMBL112570

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-7.93 -7.91
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-7.73 -7.66
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-7.86 -7.76 -7.53
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-7.71 -7.45 -7.13
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-7.63 -7.72 -8.47
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-7.98 -6.86
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-7.64 -7.03 -7.21
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-8.03 -7.75
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-7.93 -7.14
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-8.10 -7.86
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-6.94 -7.20
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-7.12 -6.94 -6.92
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-6.67 -8.28
Similarity Score:
N/A
Best Match:
N/A

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

Docking Scores:
-0.64
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N6

Docking Scores:
-7.36 -7.20 -7.98
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-6.32 -8.03 -8.68
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-7.86 -7.82 -7.37
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-7.93 -7.63 -7.78
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-7.89 -7.53
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-7.99 -7.93 -8.18
Similarity Score:
N/A
Best Match:
N/A

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-8.49 -6.75 -7.72
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-7.34 -7.20
Similarity Score:
28.12%
Best Match:
CHEMBL335808

NP_A-H1N1

Docking Scores:
-7.45 -6.21 -6.76
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.12 -7.65 -7.77
Similarity Score:
3.75%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

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

NP_SARS

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

NS3_HCV1A

Docking Scores:
-7.59 -6.75 -6.74
Similarity Score:
25.00%
Best Match:
CHEMBL296588

NS3_HCV1B

Docking Scores:
-6.87 -6.47 -7.00
Similarity Score:
13.79%
Best Match:
CHEMBL3921185

NS3_HCV3A

Docking Scores:
-7.43 -7.99 -6.83
Similarity Score:
N/A
Best Match:
N/A

NS5B_HCV1A

Docking Scores:
-9.42 -10.08 -8.83
Similarity Score:
18.48%
Best Match:
CHEMBL320324

NS5B_HCV1B

Docking Scores:
-8.34 -7.44 -7.69
Similarity Score:
8.33%
Best Match:
CHEMBL3645202

NS5B_HCV2A

Docking Scores:
-7.72 -5.99
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-7.85
Similarity Score:
17.65%
Best Match:
CHEMBL1092796

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-7.52 -7.64
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-4.72
Similarity Score:
17.65%
Best Match:
CHEMBL1092796

NSP3_HCoV-229E

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

NSP3_IBV

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

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.47 -6.26
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-8.24 -8.30 -8.87
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-10.05 -10.16 -10.12
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.93 -8.49 -9.01
Similarity Score:
13.83%
Best Match:
CHEMBL2040554

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-8.76 -9.19
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-7.77 -7.81 -9.17
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

Docking Scores:
-8.84
Similarity Score:
N/A
Best Match:
N/A

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-7.59 -7.70 -8.05
Similarity Score:
13.22%
Best Match:
CHEMBL213054

PLP_SARS2

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

PR_FCoV

Docking Scores:
-8.49
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-229E

Docking Scores:
-7.57 -7.85
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-4.19 -8.51
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-8.38 -7.93 -7.71
Similarity Score:
8.84%
Best Match:
CHEMBL492666

PR_HIV2

Docking Scores:
-8.71 -7.05
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-8.50 -7.29 -7.76
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-6.67 -8.24
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-6.84 -6.66 -7.02
Similarity Score:
17.65%
Best Match:
CHEMBL1092796

PR_SARS2

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

PR_TGEV

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

RDRP_SARS2

Docking Scores:
-7.40
Similarity Score:
5.32%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-8.43 -8.07 -8.51
Similarity Score:
40.43%
Best Match:
CHEMBL404519

SPIKE_HCoV-229E

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

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-8.69 -6.92 -6.89
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-7.33 -7.82
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-6.70 -6.65 -6.66
Similarity Score:
N/A
Best Match:
N/A