jj #412 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-4.57 -5.16
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

Docking Scores:
-5.08
Similarity Score:
N/A
Best Match:
N/A

3A_HED68

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

3C_HE71

Docking Scores:
-6.95 -6.48
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

Docking Scores:
-4.89
Similarity Score:
N/A
Best Match:
N/A

3D_HE71

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

3D_HED68

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

ACE2_HUMAN

Docking Scores:
-8.18
Similarity Score:
33.64%
Best Match:
CHEMBL254703

CAPSD_9CALI

Docking Scores:
-7.01 -6.62 -6.91
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

Docking Scores:
-9.67
Similarity Score:
N/A
Best Match:
N/A

CAPSD_DEN2P

Docking Scores:
-8.09
Similarity Score:
N/A
Best Match:
N/A

CAPSD_HCV77

Docking Scores:
-3.78
Similarity Score:
23.30%
Best Match:
CHEMBL4107993

CAPSD_HED68

Docking Scores:
-8.45 -9.03
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.94 -5.96
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-8.49
Similarity Score:
10.65%
Best Match:
CHEMBL479371

E1_9HEPC

Docking Scores:
-4.61
Similarity Score:
N/A
Best Match:
N/A

E1_HCV77

Docking Scores:
-3.74
Similarity Score:
23.30%
Best Match:
CHEMBL4107993

E1_HCVJ1

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

E2_9HEPC

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

E2_HCV77

Docking Scores:
-5.33
Similarity Score:
23.30%
Best Match:
CHEMBL4107993

ENV_9FLAV

Docking Scores:
-4.59
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN1B

Docking Scores:
-4.34
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

Docking Scores:
-4.73
Similarity Score:
N/A
Best Match:
N/A

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
-3.76 -6.50 -6.45
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-7.18 -6.73 -5.09
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-7.73 -5.95
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-6.49 -5.76
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-7.30 -7.41 -7.51
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

Docking Scores:
-5.09
Similarity Score:
N/A
Best Match:
N/A

GP_EBOV

Docking Scores:
-6.61 -8.06 -7.98
Similarity Score:
27.96%
Best Match:
CHEMBL1655

GP_LASSJ

Docking Scores:
-5.68 -5.63
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-5.24 -5.21
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.39 -6.15
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-5.34 -5.44 -5.38
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-6.06 -4.94 -4.78
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.21 -5.27 -5.04
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.16 -4.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-5.03 -4.89 -5.13
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-5.37 -5.48
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-6.01 -5.56
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-6.23 -5.40
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.11 -5.09
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-8.34 -8.03 -7.15
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-8.27 -7.43
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

Docking Scores:
-5.12
Similarity Score:
N/A
Best Match:
N/A

MTASE_SARS2

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

MX2_A-H5N1

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

MX_9MONO

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

MX_LASSJ

Docking Scores:
-4.53
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N6

Docking Scores:
-6.44 -6.79 -6.66
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-7.87 -6.75 -6.70
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-6.41 -6.64 -6.39
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-6.37 -6.28 -5.93
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-6.37 -6.48
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-6.49 -6.24 -6.79
Similarity Score:
15.92%
Best Match:
CHEMBL4292576

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-6.31 -6.48 -6.25
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-6.61 -5.68
Similarity Score:
12.75%
Best Match:
CHEMBL81286

NP_9ADNV

Docking Scores:
-5.43 -7.30
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-5.78 -7.64 -6.10
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.75 -5.13 -6.73
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.48 -7.10 -6.48
Similarity Score:
7.22%
Best Match:
CHEMBL3233481

NP_INFB

Docking Scores:
-4.60
Similarity Score:
N/A
Best Match:
N/A

NP_INFD

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

NP_LASSJ

Docking Scores:
-8.92 -8.80 -3.97
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-5.52 -5.03 -5.04
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

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

NS1_DEN1W

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

NS1_ZIKV

Docking Scores:
-6.46 -6.42 -5.88
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

Docking Scores:
-3.92
Similarity Score:
N/A
Best Match:
N/A

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-7.34 -6.54
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-6.49 -6.85
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-8.14 -6.98
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-6.60 -6.10 -8.64
Similarity Score:
23.30%
Best Match:
CHEMBL4107993

NS3_HCV1B

Docking Scores:
-8.85 -8.33 -5.63
Similarity Score:
12.61%
Best Match:
CHEMBL1170408

NS3_HCV3A

Docking Scores:
-6.46 -6.43 -6.76
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-6.65 -8.55 -8.54
Similarity Score:
23.21%
Best Match:
CHEMBL446360

NS5B_HCV1B

Docking Scores:
-7.19 -8.34 -8.24
Similarity Score:
15.58%
Best Match:
CHEMBL3645180

NS5B_HCV2A

Docking Scores:
-9.07 -8.66
Similarity Score:
10.96%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-7.03 -7.84
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-6.53 -5.02
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

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

NS6_9CALI

Docking Scores:
-4.08 -5.63 -6.28
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-6.25
Similarity Score:
36.36%
Best Match:
CHEMBL471187

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-6.03 -5.89
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-5.98
Similarity Score:
36.36%
Best Match:
CHEMBL471187

NSP3_HCoV-229E

Docking Scores:
-9.43
Similarity Score:
N/A
Best Match:
N/A

NSP3_IBV

Docking Scores:
-8.56
Similarity Score:
N/A
Best Match:
N/A

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.41 -5.73
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-7.41 -7.73 -7.78
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-6.66 -6.56 -6.55
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.71 -6.18 -5.98
Similarity Score:
31.03%
Best Match:
CHEMBL3600947

PA_INFB

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

PB2_A-H3N2

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

PB2_A-H5N1

Docking Scores:
-6.53 -8.09 -8.35
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-8.39 -8.97 -7.99
Similarity Score:
35.00%
Best Match:
CHEMBL222735

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-8.03 -7.95
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-7.30
Similarity Score:
12.58%
Best Match:
CHEMBL4214471

PR_HCoV-229E

Docking Scores:
-6.14 -5.78
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-5.21 -6.17
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.39 -6.32 -6.49
Similarity Score:
16.98%
Best Match:
CHEMBL510485

PR_HIV2

Docking Scores:
-6.36 -6.15
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-6.10 -6.66 -6.29
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-6.94 -6.35
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-7.01 -6.87 -6.52
Similarity Score:
36.36%
Best Match:
CHEMBL471187

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-5.23
Similarity Score:
10.78%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-9.74 -9.96 -10.26
Similarity Score:
19.00%
Best Match:
CHEMBL3775172

SPIKE_HCoV-229E

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

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-6.09 -5.10 -4.90
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-5.70 -5.69
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-6.02 -5.88 -6.53
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

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

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

Docking Scores:
-3.97
Similarity Score:
N/A
Best Match:
N/A

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-5.12 -6.87 -6.82
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.58 -5.36
Similarity Score:
N/A
Best Match:
N/A