JJJ002 #409 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-5.30 -5.97
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

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

3A_HED68

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

3C_HE71

Docking Scores:
-6.90 -6.63
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

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

3D_HE71

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

3D_HED68

Docking Scores:
-7.70
Similarity Score:
N/A
Best Match:
N/A

ACE2_HUMAN

Docking Scores:
-8.94
Similarity Score:
18.26%
Best Match:
CHEMBL258333

CAPSD_9CALI

Docking Scores:
-7.71 -7.23 -8.18
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

Docking Scores:
-10.65
Similarity Score:
N/A
Best Match:
N/A

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-5.37
Similarity Score:
24.56%
Best Match:
CHEMBL3645761

CAPSD_HED68

Docking Scores:
-9.11 -9.62
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.95 -7.19
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-7.83
Similarity Score:
17.13%
Best Match:
CHEMBL481172

E1_9HEPC

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

E1_HCV77

Docking Scores:
-4.71
Similarity Score:
24.56%
Best Match:
CHEMBL3645761

E1_HCVJ1

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

E2_9HEPC

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

E2_HCV77

Docking Scores:
-5.94
Similarity Score:
24.56%
Best Match:
CHEMBL3645761

ENV_9FLAV

Docking Scores:
-4.85
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN1B

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

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

Docking Scores:
-5.53
Similarity Score:
N/A
Best Match:
N/A

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
-4.68 -7.01 -7.16
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-7.78 -7.75 -6.09
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-7.53 -7.40
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-7.42 -6.48
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-6.55 -6.86 -6.39
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-7.78 -8.18 -7.56
Similarity Score:
37.72%
Best Match:
CHEMBL4640931

GP_LASSJ

Docking Scores:
-6.04 -5.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-6.90 -7.05
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.93 -6.28
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-6.29 -6.25 -6.12
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-5.95 -6.14 -6.19
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.52 -6.80 -6.70
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.60 -6.02
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-6.17 -5.80 -5.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-6.06 -6.32
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-6.68 -6.47
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-6.48 -6.16
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-6.49 -6.53
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-8.76 -8.10 -8.05
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-8.69 -8.41
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

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

MX_9MONO

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

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-7.61 -7.59 -6.73
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-7.77 -7.46 -7.54
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-6.51 -7.06 -7.05
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-7.23 -7.02 -7.24
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-7.20 -6.52
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-7.10 -7.45 -7.40
Similarity Score:
16.85%
Best Match:
CHEMBL4287425

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-7.09 -7.02 -7.43
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-6.86 -6.93
Similarity Score:
23.49%
Best Match:
CHEMBL4161935

NP_9ADNV

Docking Scores:
-5.24 -8.04
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-6.71 -8.12 -6.37
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-7.48 -6.74 -6.58
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.96 -7.98 -7.50
Similarity Score:
34.78%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

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

NP_LASSJ

Docking Scores:
-9.06 -9.14 -4.69
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-6.33 -5.19 -6.51
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

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

NS1_DEN1W

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

NS1_ZIKV

Docking Scores:
-4.62 -7.03 -6.57
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

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

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-7.97 -7.56
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-8.36 -6.81
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-7.96 -7.71
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-6.39 -6.20 -8.06
Similarity Score:
24.56%
Best Match:
CHEMBL3645761

NS3_HCV1B

Docking Scores:
-7.16 -7.98 -6.43
Similarity Score:
19.89%
Best Match:
CHEMBL3954962

NS3_HCV3A

Docking Scores:
-7.01 -7.10 -7.27
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-8.15 -9.06 -9.08
Similarity Score:
25.93%
Best Match:
CHEMBL3644925

NS5B_HCV1B

Docking Scores:
-8.54 -9.11 -9.40
Similarity Score:
25.67%
Best Match:
CHEMBL3645183

NS5B_HCV2A

Docking Scores:
-9.52 -9.58
Similarity Score:
31.88%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-6.85 -8.43
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-8.02 -5.96
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

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

NS6_9CALI

Docking Scores:
-5.72 -5.98 -6.25
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-6.48
Similarity Score:
16.13%
Best Match:
CHEMBL3105073

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-6.85 -6.62
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-5.93
Similarity Score:
16.13%
Best Match:
CHEMBL3105073

NSP3_HCoV-229E

Docking Scores:
-9.48
Similarity Score:
N/A
Best Match:
N/A

NSP3_IBV

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

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-7.33 -6.42
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-7.97 -7.94 -7.61
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-7.75 -8.03 -7.37
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.64 -7.35 -7.49
Similarity Score:
33.88%
Best Match:
CHEMBL2070214

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.92 -7.85
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-7.11 -8.21 -7.42
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-8.01 -8.66 -8.99
Similarity Score:
36.29%
Best Match:
CHEMBL358279

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-8.04 -7.85
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-7.62
Similarity Score:
13.10%
Best Match:
CHEMBL4214471

PR_HCoV-229E

Docking Scores:
-7.39 -7.55
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-4.68 -7.62
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.66 -6.97 -7.00
Similarity Score:
13.66%
Best Match:
CHEMBL523528

PR_HIV2

Docking Scores:
-7.73 -6.55
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-7.59 -8.26 -8.29
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-7.49 -7.87
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-7.40 -6.83 -7.30
Similarity Score:
16.13%
Best Match:
CHEMBL3105073

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-6.26
Similarity Score:
10.42%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-9.50 -9.90 -10.89
Similarity Score:
22.56%
Best Match:
CHEMBL4227382

SPIKE_HCoV-229E

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

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-6.44 -6.25 -5.37
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-6.35 -6.58
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-6.35 -6.90 -7.08
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

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

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

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

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-6.50 -7.32 -7.31
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.41 -5.40
Similarity Score:
N/A
Best Match:
N/A