111 #252 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACE2_HUMAN

Docking Scores:
-6.60
Similarity Score:
29.90%
Best Match:
CHEMBL254900

GP160_HIV1

Docking Scores:
-5.67 -5.32 -5.06
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-5.12 -4.70 -4.55
Similarity Score:
27.22%
Best Match:
CHEMBL3125897

HA_A-H10N7

Docking Scores:
-4.84
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N8

Docking Scores:
-4.65
Similarity Score:
N/A
Best Match:
N/A

HA_A-H13N6

Docking Scores:
-4.97
Similarity Score:
N/A
Best Match:
N/A

HA_A-H14N6

Docking Scores:
-4.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H15N9

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

HA_A-H17N10

Docking Scores:
-4.57
Similarity Score:
N/A
Best Match:
N/A

HA_A-H18N11

Docking Scores:
-5.14
Similarity Score:
N/A
Best Match:
N/A

HA_A-H1N1

Docking Scores:
-5.64 -4.72
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.07 -5.15
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-5.75 -5.35 -4.36
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-4.77 -4.77 -4.58
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-5.40 -5.66 -5.31
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-5.13 -5.17
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

Docking Scores:
-4.65
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N6

Docking Scores:
-5.01
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N2

Docking Scores:
-4.87 -4.69 -4.81
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-4.78 -5.38
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-5.56 -5.16
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

Docking Scores:
-4.25
Similarity Score:
N/A
Best Match:
N/A

HE_BCV

Docking Scores:
-5.58 -5.16
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

Docking Scores:
-4.55
Similarity Score:
N/A
Best Match:
N/A

HE_MHV

Docking Scores:
-4.95
Similarity Score:
N/A
Best Match:
N/A

IN_HIV1

Docking Scores:
-4.19 -4.26
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-6.49 -6.67 -6.45
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-5.69 -6.43
Similarity Score:
N/A
Best Match:
N/A

MTASE_SARS2

Docking Scores:
-5.20
Similarity Score:
N/A
Best Match:
N/A

MTASE_SARS2

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

MX2_A-H5N1

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

NA_A-H11N6

Docking Scores:
-6.74 -6.51 -6.56
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-5.27 -6.25 -6.42
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-6.13 -6.59 -6.33
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

Docking Scores:
-4.80
Similarity Score:
N/A
Best Match:
N/A

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-6.43 -6.55 -6.04
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-6.04 -6.22
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-6.26 -6.71 -6.21
Similarity Score:
N/A
Best Match:
N/A

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-6.45 -6.03 -6.20
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-6.23 -6.56
Similarity Score:
63.37%
Best Match:
CHEMBL183817

NP_A-H1N1

Docking Scores:
-4.48 -5.01 -5.36
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-5.13 -5.14 -5.32
Similarity Score:
9.38%
Best Match:
CHEMBL3233481

NP_INFB

Docking Scores:
-4.45
Similarity Score:
N/A
Best Match:
N/A

NP_INFD

Docking Scores:
-4.14
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS3_HCV1A

Docking Scores:
-5.53 -5.27 -5.67
Similarity Score:
38.68%
Best Match:
CHEMBL296588

NS3_HCV1B

Docking Scores:
-5.64 -5.37 -5.17
Similarity Score:
27.32%
Best Match:
CHEMBL3954962

NS3_HCV3A

Docking Scores:
-5.78 -5.73 -5.86
Similarity Score:
N/A
Best Match:
N/A

NS5B_HCV1A

Docking Scores:
-6.25 -5.50 -6.19
Similarity Score:
29.77%
Best Match:
CHEMBL163917

NS5B_HCV1B

Docking Scores:
-5.32 -5.54 -5.43
Similarity Score:
18.91%
Best Match:
CHEMBL3645211

NS5B_HCV2A

Docking Scores:
-6.71 -6.90
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-5.12
Similarity Score:
19.62%
Best Match:
CHEMBL2441741

NSP15_SARS2

Docking Scores:
-4.91
Similarity Score:
N/A
Best Match:
N/A

NSP1_INFB

Docking Scores:
-4.03 -4.22
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-5.61
Similarity Score:
19.62%
Best Match:
CHEMBL2441741

NSP3_HCoV-229E

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

NSP3_IBV

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

NSP3_MHV

Docking Scores:
-4.78
Similarity Score:
N/A
Best Match:
N/A

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-4.80 -4.79
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-5.40 -5.49 -5.76
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-6.17 -5.96 -5.78
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-5.42 -5.95 -5.57
Similarity Score:
18.12%
Best Match:
CHEMBL278402

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-5.20 -5.31
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-5.42 -5.15 -4.84
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

Docking Scores:
-4.96
Similarity Score:
N/A
Best Match:
N/A

PB3_A-H3N2

Docking Scores:
-5.16
Similarity Score:
N/A
Best Match:
N/A

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-6.78 -6.54 -6.08
Similarity Score:
30.20%
Best Match:
CHEMBL213054

PLP_SARS2

Docking Scores:
-4.94
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-5.06
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-229E

Docking Scores:
-5.45 -5.14
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-3.79 -5.90
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-4.97 -4.93 -4.99
Similarity Score:
28.81%
Best Match:
CHEMBL450294

PR_HIV2

Docking Scores:
-5.23 -4.78
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

Docking Scores:
-5.60
Similarity Score:
N/A
Best Match:
N/A

PR_HKU4

Docking Scores:
-4.95 -5.54 -5.48
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

Docking Scores:
-5.04
Similarity Score:
N/A
Best Match:
N/A

PR_MERs

Docking Scores:
-5.78 -5.49
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-5.28 -5.76 -5.11
Similarity Score:
19.62%
Best Match:
CHEMBL2441741

PR_SARS2

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

PR_TGEV

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

RDRP_SARS2

Docking Scores:
-5.33
Similarity Score:
16.38%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-6.46 -6.63 -6.99
Similarity Score:
24.65%
Best Match:
CHEMBL4225614

SPIKE_HCoV-229E

Docking Scores:
-4.05
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-NL63

Docking Scores:
-4.54
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-OC43

Docking Scores:
-5.65
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HKU4

Docking Scores:
-5.82
Similarity Score:
N/A
Best Match:
N/A

SPIKE_IBV

Docking Scores:
-4.58
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MERs

Docking Scores:
-5.37 -5.38 -4.45
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

Docking Scores:
-4.80
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS

Docking Scores:
-4.82 -5.34
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-4.72 -4.37 -5.15
Similarity Score:
N/A
Best Match:
N/A