jj #413 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-5.06 -5.60
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

Docking Scores:
-5.33
Similarity Score:
N/A
Best Match:
N/A

3A_HED68

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

3C_HE71

Docking Scores:
-5.71 -5.74
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

Docking Scores:
-5.21
Similarity Score:
N/A
Best Match:
N/A

3D_HE71

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

3D_HED68

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

ACE2_HUMAN

Docking Scores:
-7.68
Similarity Score:
12.50%
Best Match:
CHEMBL258333

CAPSD_9CALI

Docking Scores:
-6.63 -6.41 -7.33
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

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

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-4.79
Similarity Score:
16.33%
Best Match:
CHEMBL4106916

CAPSD_HED68

Docking Scores:
-8.64 -8.84
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.34 -5.99
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-7.19
Similarity Score:
7.66%
Best Match:
CHEMBL481172

E1_9HEPC

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

E1_HCV77

Docking Scores:
-4.02
Similarity Score:
16.33%
Best Match:
CHEMBL4106916

E1_HCVJ1

Docking Scores:
-4.24
Similarity Score:
N/A
Best Match:
N/A

E2_9HEPC

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

E2_HCV77

Docking Scores:
-5.18
Similarity Score:
16.33%
Best Match:
CHEMBL4106916

ENV_9FLAV

Docking Scores:
-4.83
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN1B

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

ENV_DEN2P

Docking Scores:
-5.55
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN3P

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

ENV_HHV2H

Docking Scores:
-5.97
Similarity Score:
N/A
Best Match:
N/A

ENV_ZIKV

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

ENV_ZIKVK

Docking Scores:
-4.92
Similarity Score:
N/A
Best Match:
N/A

G1_ADNV

Docking Scores:
-3.63 -6.23 -6.23
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-6.52 -6.88 -5.46
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-7.33 -6.77
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-6.83 -6.24
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-6.78 -6.43 -5.51
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-6.91 -7.43 -7.17
Similarity Score:
21.70%
Best Match:
CHEMBL4640931

GP_LASSJ

Docking Scores:
-5.71 -5.19
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

Docking Scores:
-4.76
Similarity Score:
N/A
Best Match:
N/A

HA_A-H1N1

Docking Scores:
-5.74 -5.90
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.19 -5.22
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-5.80 -5.62 -5.16
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-5.11 -5.13 -5.22
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-5.61 -7.07 -5.69
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.03 -5.46
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-5.61 -5.05 -5.50
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-5.30 -5.87
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-6.09 -5.61
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-6.12 -5.55
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.11 -5.36
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-7.63 -7.85 -7.19
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-8.11 -7.33
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

Docking Scores:
-5.26
Similarity Score:
N/A
Best Match:
N/A

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

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

MX_9MONO

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

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-6.86 -6.64 -6.29
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-5.10 -6.74 -6.47
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-6.52 -6.02 -6.21
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

Docking Scores:
-5.83
Similarity Score:
N/A
Best Match:
N/A

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-6.19 -6.04 -6.51
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-6.20 -5.91
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-5.87 -7.15 -6.95
Similarity Score:
6.88%
Best Match:
CHEMBL4285767

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-6.04 -6.13 -6.58
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-5.81 -6.03
Similarity Score:
12.74%
Best Match:
CHEMBL4161935

NP_9ADNV

Docking Scores:
-5.02 -6.77
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-5.74 -6.88 -6.29
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.44 -5.99 -5.37
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-7.89 -6.48 -6.24
Similarity Score:
31.51%
Best Match:
CHEMBL3233481

NP_INFB

Docking Scores:
-4.74
Similarity Score:
N/A
Best Match:
N/A

NP_INFD

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

NP_LASSJ

Docking Scores:
-8.80 -8.33 -4.16
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-5.14 -5.18 -5.78
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

Docking Scores:
-5.22
Similarity Score:
N/A
Best Match:
N/A

NS1_DEN1W

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

NS1_ZIKV

Docking Scores:
-5.52 -6.73 -5.85
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

Docking Scores:
-4.33
Similarity Score:
N/A
Best Match:
N/A

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-6.91 -7.11
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-6.56 -7.06
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-6.65 -6.36
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-5.70 -5.66 -6.70
Similarity Score:
16.33%
Best Match:
CHEMBL4106916

NS3_HCV1B

Docking Scores:
-6.51 -6.98 -5.90
Similarity Score:
10.94%
Best Match:
CHEMBL3125634

NS3_HCV3A

Docking Scores:
-6.37 -6.89 -6.30
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-6.77 -7.69 -7.83
Similarity Score:
18.92%
Best Match:
CHEMBL3644925

NS5B_HCV1B

Docking Scores:
-6.72 -6.77 -7.99
Similarity Score:
26.09%
Best Match:
CHEMBL99408

NS5B_HCV2A

Docking Scores:
-7.85 -8.21
Similarity Score:
18.46%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-5.82 -6.74
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-6.80 -4.93
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

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

NS6_9CALI

Docking Scores:
-4.35 -5.42 -5.29
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-5.60
Similarity Score:
9.84%
Best Match:
CHEMBL471187

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-6.22 -5.46
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-5.33
Similarity Score:
9.84%
Best Match:
CHEMBL471187

NSP3_HCoV-229E

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

NSP3_IBV

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

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.18 -6.79
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-6.76 -6.26 -6.50
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-7.02 -6.35 -6.79
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.38 -6.26 -6.13
Similarity Score:
21.82%
Best Match:
CHEMBL2070214

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.24 -7.48
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-6.74 -6.56 -6.81
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-7.69 -7.60 -7.66
Similarity Score:
19.49%
Best Match:
CHEMBL358279

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-7.68 -7.25
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-6.24
Similarity Score:
8.00%
Best Match:
CHEMBL4214471

PR_HCoV-229E

Docking Scores:
-6.57 -5.95
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-4.36 -6.50
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-5.93 -5.95 -5.87
Similarity Score:
8.12%
Best Match:
CHEMBL492666

PR_HIV2

Docking Scores:
-6.98 -5.78
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-6.27 -6.52 -6.60
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-6.54 -6.49
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-6.21 -6.36 -6.48
Similarity Score:
9.84%
Best Match:
CHEMBL471187

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-5.38
Similarity Score:
7.01%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-8.54 -8.79 -8.96
Similarity Score:
16.38%
Best Match:
CHEMBL4227382

SPIKE_HCoV-229E

Docking Scores:
-4.21
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-6.10 -5.86 -4.90
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-6.17 -6.15
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-5.31 -5.30 -5.41
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

Docking Scores:
-6.29
Similarity Score:
N/A
Best Match:
N/A

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

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

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-5.16 -6.43 -5.87
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.10 -4.95
Similarity Score:
N/A
Best Match:
N/A