Nirmatrelvir #417 Output - VIRUS-CKB

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Nirmatrelvir #417 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-5.65 -6.15
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

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

3A_HED68

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

3C_HE71

Docking Scores:
-6.78 -6.46
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

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

3D_HE71

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

3D_HED68

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

ACE2_HUMAN

Docking Scores:
-9.40
Similarity Score:
38.64%
Best Match:
CHEMBL254900

CAPSD_9CALI

Docking Scores:
-7.25 -7.13 -7.40
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

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

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-4.50
Similarity Score:
60.67%
Best Match:
CHEMBL296588

CAPSD_HED68

Docking Scores:
-7.87 -8.58
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.58 -5.76
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-7.67
Similarity Score:
16.31%
Best Match:
CHEMBL479371

E1_9HEPC

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

E1_HCV77

Docking Scores:
-3.96
Similarity Score:
60.67%
Best Match:
CHEMBL296588

E1_HCVJ1

Docking Scores:
-4.87
Similarity Score:
N/A
Best Match:
N/A

E2_9HEPC

Docking Scores:
-8.00
Similarity Score:
N/A
Best Match:
N/A

E2_HCV77

Docking Scores:
-6.10
Similarity Score:
60.67%
Best Match:
CHEMBL296588

ENV_9FLAV

Docking Scores:
-4.91
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN1B

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

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

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

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
-3.58 -6.01 -6.16
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-7.01 -7.23 -6.41
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-6.99 -7.22
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-6.93 -6.40
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

Docking Scores:
-6.11
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV1

Docking Scores:
-6.83 -7.22 -7.33
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-7.04 -7.03 -6.62
Similarity Score:
33.54%
Best Match:
CHEMBL3125897

GP_LASSJ

Docking Scores:
-6.19 -5.96
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

Docking Scores:
-6.11
Similarity Score:
N/A
Best Match:
N/A

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-6.41 -6.40
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.75 -6.48
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-6.99 -6.86 -6.67
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-6.45 -6.26 -6.35
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.22 -7.31 -6.88
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.17 -6.47
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-6.57 -5.66 -6.01
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-6.50 -6.77
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

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

HA_INFD

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

HE_BCV

Docking Scores:
-6.56 -6.28
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.45 -5.77
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-8.90 -8.83 -7.56
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-8.82 -7.06
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

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

MTASE_SARS2

Docking Scores:
-7.89
Similarity Score:
N/A
Best Match:
N/A

MX2_A-H5N1

Docking Scores:
-3.78
Similarity Score:
N/A
Best Match:
N/A

MX_9MONO

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

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-8.41 -8.20 -7.83
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-5.59 -8.36 -8.06
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-8.03 -8.04 -7.69
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-8.02 -7.74 -7.38
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-6.97 -7.40
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-8.53 -8.51 -8.05
Similarity Score:
29.71%
Best Match:
CHEMBL674

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-7.93 -7.45 -8.29
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-7.27 -7.98
Similarity Score:
55.10%
Best Match:
CHEMBL370047

NP_9ADNV

Docking Scores:
-5.14 -7.09
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-6.47 -6.10 -6.35
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.23 -6.12 -7.01
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.25 -6.90 -6.77
Similarity Score:
15.25%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

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

NP_LASSJ

Docking Scores:
-9.13 -8.81 -5.12
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-5.43 -5.57 -6.15
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

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

NS1_DEN1W

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

NS1_ZIKV

Docking Scores:
2.43 -6.46 -7.10
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

Docking Scores:
-4.48
Similarity Score:
N/A
Best Match:
N/A

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-6.52 -7.44
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-7.12 -7.38
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-7.64 -8.07
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-6.82 -5.96 -6.22
Similarity Score:
60.67%
Best Match:
CHEMBL296588

NS3_HCV1B

Docking Scores:
-6.76 -6.80 -5.54
Similarity Score:
50.50%
Best Match:
CHEMBL3921185

NS3_HCV3A

Docking Scores:
-6.89 -6.30 -6.40
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-7.98 -8.13 -8.01
Similarity Score:
52.00%
Best Match:
CHEMBL13443

NS5B_HCV1B

Docking Scores:
-7.55 -7.93 -6.90
Similarity Score:
20.75%
Best Match:
CHEMBL3422106

NS5B_HCV2A

Docking Scores:
-9.62 -6.16
Similarity Score:
34.72%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-7.07 -8.26
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-8.03 -5.88
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

Docking Scores:
-8.68
Similarity Score:
N/A
Best Match:
N/A

NS6_9CALI

Docking Scores:
-5.19 -5.31 -6.29
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-6.37
Similarity Score:
42.31%
Best Match:
CHEMBL2441741

NSP15_SARS2

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

NSP1_INFB

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

NSP1_SARS

Docking Scores:
-6.15
Similarity Score:
42.31%
Best Match:
CHEMBL2441741

NSP3_HCoV-229E

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

NSP3_IBV

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

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

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

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-7.61 -7.57 -7.81
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-7.81 -7.48 -7.56
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.22 -7.35 -7.70
Similarity Score:
24.03%
Best Match:
CHEMBL2040554

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.29 -7.64
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-7.64 -6.94 -7.42
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

Docking Scores:
-7.79
Similarity Score:
N/A
Best Match:
N/A

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-7.34 -7.42 -8.27
Similarity Score:
42.86%
Best Match:
CHEMBL213054

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-7.20 -7.64
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-7.04
Similarity Score:
52.83%
Best Match:
CHEMBL4214066

PR_HCoV-229E

Docking Scores:
-7.67 -7.48
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-4.55 -7.50
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.46 -6.72 -7.03
Similarity Score:
17.03%
Best Match:
CHEMBL492666

PR_HIV2

Docking Scores:
-7.47 -6.82
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-6.75 -7.19 -7.32
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-7.55 -8.02
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-6.87 -7.34 -7.32
Similarity Score:
42.31%
Best Match:
CHEMBL2441741

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-6.54
Similarity Score:
10.37%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-8.05 -8.30 -7.19
Similarity Score:
33.58%
Best Match:
CHEMBL4225865

SPIKE_HCoV-229E

Docking Scores:
-4.66
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-NL63

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

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-7.21 -6.20 -5.53
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

Docking Scores:
-6.27 -6.61
Similarity Score:
N/A
Best Match:
N/A

SPIKE_SARS2

Docking Scores:
-5.64 -6.37 -7.36
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

Docking Scores:
-7.36
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:
-5.09
Similarity Score:
N/A
Best Match:
N/A

VP24_EBOZM

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

VP30_9MONO

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

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-5.91 -5.85 -6.47
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.16 -5.73
Similarity Score:
N/A
Best Match:
N/A