Telaprevir #415 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-6.95 -5.87
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

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

3A_HED68

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

3C_HE71

Docking Scores:
-6.52 -7.35
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

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

3D_HE71

Docking Scores:
-7.58
Similarity Score:
N/A
Best Match:
N/A

3D_HED68

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A

ACE2_HUMAN

Docking Scores:
-11.10
Similarity Score:
32.33%
Best Match:
CHEMBL1240682

CAPSD_9CALI

Docking Scores:
-8.13 -8.08 -8.83
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

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

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-5.40
Similarity Score:
67.11%
Best Match:
CHEMBL3645733

CAPSD_HED68

Docking Scores:
-9.77 -9.58
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.13 -6.80
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-8.64
Similarity Score:
25.40%
Best Match:
CHEMBL479371

E1_9HEPC

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

E1_HCV77

Docking Scores:
-4.25
Similarity Score:
67.11%
Best Match:
CHEMBL3645733

E1_HCVJ1

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

E2_9HEPC

Docking Scores:
-8.49
Similarity Score:
N/A
Best Match:
N/A

E2_HCV77

Docking Scores:
-5.89
Similarity Score:
67.11%
Best Match:
CHEMBL3645733

ENV_9FLAV

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

ENV_DEN1B

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

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

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

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
28.41 -6.85 -6.20
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-8.91 -8.46 -7.00
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

Docking Scores:
-7.47
Similarity Score:
N/A
Best Match:
N/A

GB_HHV1K

Docking Scores:
-7.11 -7.39
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-8.12 -6.53
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-6.94 -6.58 -7.08
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-8.12 -8.13 -7.91
Similarity Score:
31.23%
Best Match:
CHEMBL3125895

GP_LASSJ

Docking Scores:
-6.81 -6.39
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-7.75 -6.93
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-6.14 -6.75
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-6.19 -6.48 -6.49
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-6.56 -7.39 -6.83
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.41 -7.03 -7.20
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.45 -6.28
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-6.78 -6.31 -6.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-5.85 -6.84
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-7.00 -7.30
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-8.32 -7.22
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.21 -6.12
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-7.52 -7.37 -8.94
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-8.15 -9.35
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

Docking Scores:
16.80
Similarity Score:
N/A
Best Match:
N/A

MX_9MONO

Docking Scores:
-9.26
Similarity Score:
N/A
Best Match:
N/A

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-7.59 -7.55 -7.18
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-6.28 -7.61 -9.37
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-9.14 -7.88 -7.80
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-8.58 -8.55 -8.46
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-8.69 -7.35
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-9.08 -8.94 -9.08
Similarity Score:
26.83%
Best Match:
CHEMBL4287425

NA_A-H5N1

Docking Scores:
-8.53
Similarity Score:
N/A
Best Match:
N/A

NA_A-H7N9

Docking Scores:
-9.28 -8.99 -8.50
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-7.78 -7.36
Similarity Score:
42.76%
Best Match:
CHEMBL195288

NP_9ADNV

Docking Scores:
-5.48 -8.83
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-6.54 -5.79 -6.98
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.74 -6.21 -8.47
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.01 -7.96 -7.42
Similarity Score:
17.33%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

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

NP_LASSJ

Docking Scores:
-10.58 -10.55 -4.37
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-6.06 -4.74 -6.53
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

Docking Scores:
-6.51
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:
26.97 -6.96 -8.13
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

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

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-8.01 -8.21
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-6.84 -7.11
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

Docking Scores:
-9.46
Similarity Score:
N/A
Best Match:
N/A

NS3_DEN4T

Docking Scores:
-8.86 -9.14
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-6.90 -6.30 -7.67
Similarity Score:
67.11%
Best Match:
CHEMBL3645733

NS3_HCV1B

Docking Scores:
-7.27 -7.98 -6.54
Similarity Score:
100.00%
Best Match:
CHEMBL231813

NS3_HCV3A

Docking Scores:
-8.12 -7.60 -7.42
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-8.94 -8.92 -8.81
Similarity Score:
88.43%
Best Match:
CHEMBL13256

NS5B_HCV1B

Docking Scores:
-9.60 -7.70 -8.33
Similarity Score:
29.25%
Best Match:
CHEMBL3645202

NS5B_HCV2A

Docking Scores:
-8.15 -5.42
Similarity Score:
37.65%
Best Match:
CHEMBL3127326

NS5_9FLAV

Docking Scores:
-8.67
Similarity Score:
N/A
Best Match:
N/A

NS5_DEN3S

Docking Scores:
-7.72 -9.03
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-8.37 -5.90
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

Docking Scores:
-8.42
Similarity Score:
N/A
Best Match:
N/A

NS6_9CALI

Docking Scores:
-5.54 -6.04 -6.94
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-6.91
Similarity Score:
39.29%
Best Match:
CHEMBL2441745

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-6.96 -6.86
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-6.47
Similarity Score:
39.29%
Best Match:
CHEMBL2441745

NSP3_HCoV-229E

Docking Scores:
-8.66
Similarity Score:
N/A
Best Match:
N/A

NSP3_IBV

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

NSP3_MHV

Docking Scores:
-7.58
Similarity Score:
N/A
Best Match:
N/A

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.67 -6.98
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-8.36 -9.11 -8.43
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-9.83 -9.02 -9.44
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-7.85 -7.72 -8.59
Similarity Score:
31.63%
Best Match:
CHEMBL2040569

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.83 -7.75
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-6.57 -7.92 -7.13
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-8.89 -8.92 -8.71
Similarity Score:
34.50%
Best Match:
CHEMBL213054

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-8.54 -7.35
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-8.03
Similarity Score:
36.49%
Best Match:
CHEMBL4214066

PR_HCoV-229E

Docking Scores:
-7.42 -7.75
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-5.51 -8.44
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-7.04 -7.03 -7.24
Similarity Score:
20.48%
Best Match:
CHEMBL492666

PR_HIV2

Docking Scores:
-7.57 -7.31
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

Docking Scores:
-6.96
Similarity Score:
N/A
Best Match:
N/A

PR_HKU4

Docking Scores:
-6.52 -7.04 -7.12
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-7.77 -8.16
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-7.02 -6.61 -7.63
Similarity Score:
39.29%
Best Match:
CHEMBL2441745

PR_SARS2

Docking Scores:
-7.88
Similarity Score:
N/A
Best Match:
N/A

PR_TGEV

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

P_9CALI

Docking Scores:
-7.58
Similarity Score:
N/A
Best Match:
N/A

P_NVN68

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

RDRP_SARS2

Docking Scores:
-7.30
Similarity Score:
14.55%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-9.13 -9.13 -9.92
Similarity Score:
31.17%
Best Match:
CHEMBL3921297

SPIKE_HCoV-229E

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

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-6.19 -6.03 -5.81
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-6.35 -5.92
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-6.01 -6.17 -5.92
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

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

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

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

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-6.49 -7.11 -7.13
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

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