111 #449 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-6.44 -6.67
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

Docking Scores:
-5.41
Similarity Score:
N/A
Best Match:
N/A

3A_HED68

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

3C_HE71

Docking Scores:
-6.82 -6.07
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

Docking Scores:
-5.93
Similarity Score:
N/A
Best Match:
N/A

3D_HE71

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

3D_HED68

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

ACE2_HUMAN

Docking Scores:
-9.44
Similarity Score:
30.16%
Best Match:
CHEMBL436639

CAPSD_9CALI

Docking Scores:
-6.88 -6.95 -7.82
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

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

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-5.60
Similarity Score:
28.76%
Best Match:
CHEMBL3891984

CAPSD_HED68

Docking Scores:
-6.57 -8.01
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.04 -5.88
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-8.07
Similarity Score:
21.71%
Best Match:
CHEMBL479371

E1_9HEPC

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

E1_HCV77

Docking Scores:
-4.40
Similarity Score:
28.76%
Best Match:
CHEMBL3891984

E1_HCVJ1

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

E2_9HEPC

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

E2_HCV77

Docking Scores:
-6.43
Similarity Score:
28.76%
Best Match:
CHEMBL3891984

ENV_9FLAV

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

ENV_DEN1B

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

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

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

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
-4.23 -6.55 -6.30
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-8.17 -7.13 -7.08
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-6.59 -7.57
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-7.41 -6.10
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-6.60 -6.54 -6.84
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-7.23 -6.30 -7.20
Similarity Score:
33.95%
Best Match:
CHEMBL3125899

GP_LASSJ

Docking Scores:
-6.22 -6.27
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-6.34 -6.28
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-6.55 -6.77
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-6.73 -6.99 -6.33
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-6.02 -6.00 -6.43
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.68 -7.25 -6.90
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.53 -6.70
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-5.87 -6.02 -5.90
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-6.31 -6.72
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-6.81 -6.90
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

Docking Scores:
-6.12
Similarity Score:
N/A
Best Match:
N/A

HE_BCV

Docking Scores:
-5.95 -6.32
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.10 -5.18
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-6.70 -6.25 -5.87
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-6.38 -7.78
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

Docking Scores:
-2.55
Similarity Score:
N/A
Best Match:
N/A

MX_9MONO

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

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-8.31 -8.22 -8.10
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-7.44 -8.16 -8.08
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-7.80 -8.48 -8.36
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-8.29 -8.79 -7.72
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-7.87 -7.41
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-8.31 -8.86 -8.42
Similarity Score:
34.66%
Best Match:
CHEMBL4285767

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-8.22 -8.31 -8.33
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-8.09 -7.50
Similarity Score:
36.47%
Best Match:
CHEMBL4175983

NP_9ADNV

Docking Scores:
-5.30 -7.04
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-6.76 -5.80 -5.71
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.76 -6.38 -7.09
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-6.97 -6.64 -6.79
Similarity Score:
12.39%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

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

NP_LASSJ

Docking Scores:
-9.13 -8.34 -5.77
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-5.31 -5.75 -6.66
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

Docking Scores:
-5.80
Similarity Score:
N/A
Best Match:
N/A

NS1_DEN1W

Docking Scores:
-5.79
Similarity Score:
N/A
Best Match:
N/A

NS1_ZIKV

Docking Scores:
7.13 -6.07 -7.73
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

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

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-6.63 -6.58
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-7.20 -7.57
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-9.35 -8.81
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-6.51 -6.99 -6.54
Similarity Score:
28.76%
Best Match:
CHEMBL3891984

NS3_HCV1B

Docking Scores:
-7.46 -7.03 -7.29
Similarity Score:
30.86%
Best Match:
CHEMBL297884

NS3_HCV3A

Docking Scores:
-6.62 -6.23 -6.70
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-8.43 -8.32 -8.12
Similarity Score:
28.90%
Best Match:
CHEMBL3644934

NS5B_HCV1B

Docking Scores:
-8.17 -6.59 -6.35
Similarity Score:
32.69%
Best Match:
CHEMBL3645202

NS5B_HCV2A

Docking Scores:
-8.49 -5.19
Similarity Score:
27.89%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-7.67 -8.20
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-7.83 -6.25
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

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

NS6_9CALI

Docking Scores:
-4.98 -5.49 -6.73
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-7.12
Similarity Score:
24.90%
Best Match:
CHEMBL2441745

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-5.85 -6.06
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-6.50
Similarity Score:
24.90%
Best Match:
CHEMBL2441745

NSP3_HCoV-229E

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

NSP3_IBV

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

NSP3_MHV

Docking Scores:
-5.25
Similarity Score:
N/A
Best Match:
N/A

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.63 -5.77
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-7.87 -7.94 -9.04
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-8.25 -7.81 -7.78
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.33 -8.17 -7.99
Similarity Score:
35.91%
Best Match:
CHEMBL278402

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.16 -7.32
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-7.44 -6.87 -7.28
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-6.65 -6.62 -7.38
Similarity Score:
29.25%
Best Match:
CHEMBL213543

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-7.43 -8.20
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-7.61
Similarity Score:
25.57%
Best Match:
CHEMBL4214471

PR_HCoV-229E

Docking Scores:
-7.36 -6.90
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-5.02 -6.91
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.91 -7.31 -8.14
Similarity Score:
23.26%
Best Match:
CHEMBL512807

PR_HIV2

Docking Scores:
-7.37 -6.40
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-7.12 -6.80 -6.60
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-7.05 -6.94
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-7.80 -8.02 -6.45
Similarity Score:
24.90%
Best Match:
CHEMBL2441745

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-6.78
Similarity Score:
23.85%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-6.71 -5.80 -6.52
Similarity Score:
39.81%
Best Match:
CHEMBL4227382

SPIKE_HCoV-229E

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

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-7.07 -6.52 -5.70
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-6.62 -7.19
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-6.04 -6.18 -6.38
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

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

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

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

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

Docking Scores:
-6.02
Similarity Score:
N/A
Best Match:
N/A

VP35_EBOZM

Docking Scores:
-6.70 -5.98 -6.23
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.39 -5.02
Similarity Score:
N/A
Best Match:
N/A