CHEMBL415 #450 Output - VIRUS-CKB

We use cookies to improve your website experience and to gain insights into our websites' users, traffic and traffic providers to make it even better. You consent to our cookies if you continue to use our website.

CHEMBL415 #450 Output Download CSV

View Paged

Gene Protein

The docking scores are in the AutoDock Vina metric.

2A_HE71

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

2A_HE71M

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

2C_HE71

Docking Scores:
-5.20 -5.76
Similarity Score:
N/A
Best Match:
N/A

3A_9ENTO

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

3A_HE71M

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

3A_HED68

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

3C_HE71

Docking Scores:
-5.45 -5.59
Similarity Score:
N/A
Best Match:
N/A

3C_HED68

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

3D_HE71

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

3D_HED68

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

ACE2_HUMAN

Docking Scores:
-8.05
Similarity Score:
26.23%
Best Match:
CHEMBL258333

CAPSD_9CALI

Docking Scores:
-6.78 -6.83 -7.39
Similarity Score:
N/A
Best Match:
N/A

CAPSD_9ENTO

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

CAPSD_DEN2P

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

CAPSD_HCV77

Docking Scores:
-4.34
Similarity Score:
31.47%
Best Match:
CHEMBL3984600

CAPSD_HED68

Docking Scores:
-8.40 -8.84
Similarity Score:
N/A
Best Match:
N/A

CAPSD_ZIKV

Docking Scores:
-6.05 -6.45
Similarity Score:
N/A
Best Match:
N/A

DPM_HHV1K

Docking Scores:
-7.77
Similarity Score:
17.87%
Best Match:
CHEMBL479371

E1_9HEPC

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

E1_HCV77

Docking Scores:
-4.12
Similarity Score:
31.47%
Best Match:
CHEMBL3984600

E1_HCVJ1

Docking Scores:
-4.79
Similarity Score:
N/A
Best Match:
N/A

E2_9HEPC

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

E2_HCV77

Docking Scores:
-5.09
Similarity Score:
31.47%
Best Match:
CHEMBL3984600

ENV_9FLAV

Docking Scores:
-4.45
Similarity Score:
N/A
Best Match:
N/A

ENV_DEN1B

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

ENV_DEN2P

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

ENV_DEN3P

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

ENV_HHV2H

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

ENV_ZIKV

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

ENV_ZIKVK

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

G1_ADNV

Docking Scores:
-3.64 -6.93 -6.74
Similarity Score:
N/A
Best Match:
N/A

G2_ADNV

Docking Scores:
-7.22 -6.91 -5.49
Similarity Score:
N/A
Best Match:
N/A

GB_HHV11

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

GB_HHV1K

Docking Scores:
-7.32 -6.49
Similarity Score:
N/A
Best Match:
N/A

GD_9ALPH

Docking Scores:
-6.55 -5.95
Similarity Score:
N/A
Best Match:
N/A

GD_HHV1

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

GP160_HIV1

Docking Scores:
-5.50 -6.35 -5.76
Similarity Score:
N/A
Best Match:
N/A

GP160_HIV2

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

GP_EBOV

Docking Scores:
-7.00 -7.66 -7.40
Similarity Score:
32.58%
Best Match:
CHEMBL4640931

GP_LASSJ

Docking Scores:
-5.29 -5.66
Similarity Score:
N/A
Best Match:
N/A

HA_A-H10N7

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

HA_A-H10N8

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

HA_A-H13N6

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

HA_A-H14N6

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

HA_A-H15N9

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

HA_A-H17N10

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

HA_A-H18N11

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

HA_A-H1N1

Docking Scores:
-5.32 -5.62
Similarity Score:
N/A
Best Match:
N/A

HA_A-H2N2

Docking Scores:
-5.33 -6.05
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N2

Docking Scores:
-5.79 -5.92 -5.84
Similarity Score:
N/A
Best Match:
N/A

HA_A-H3N8

Docking Scores:
-5.42 -5.44 -5.56
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N1

Docking Scores:
-6.09 -6.27 -6.15
Similarity Score:
N/A
Best Match:
N/A

HA_A-H5N3

Docking Scores:
-6.41 -5.94
Similarity Score:
N/A
Best Match:
N/A

HA_A-H6N1

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

HA_A-H6N6

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

HA_A-H7N2

Docking Scores:
-5.56 -5.48 -5.34
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N7

Docking Scores:
-5.30 -5.89
Similarity Score:
N/A
Best Match:
N/A

HA_A-H7N9

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

HA_INFB

Docking Scores:
-5.99 -6.00
Similarity Score:
N/A
Best Match:
N/A

HA_INFD

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

HE_BCV

Docking Scores:
-5.76 -5.42
Similarity Score:
N/A
Best Match:
N/A

HE_HCoV-OC43

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

HE_MHV

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

IN_HIV1

Docking Scores:
-5.24 -5.51
Similarity Score:
N/A
Best Match:
N/A

MD_HKU4

Docking Scores:
-7.63 -7.20 -7.11
Similarity Score:
N/A
Best Match:
N/A

MD_MERs

Docking Scores:
-7.49 -7.15
Similarity Score:
N/A
Best Match:
N/A

MEM_9FLAV

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

MTASE_SARS2

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

MTASE_SARS2

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

MX2_A-H5N1

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

MX_9MONO

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

MX_LASSJ

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

NA_A-H11N6

Docking Scores:
-7.00 -6.99 -6.97
Similarity Score:
N/A
Best Match:
N/A

NA_A-H11N9

Docking Scores:
-5.81 -7.12 -6.92
Similarity Score:
N/A
Best Match:
N/A

NA_A-H12N5

Docking Scores:
-6.34 -6.41 -6.56
Similarity Score:
N/A
Best Match:
N/A

NA_A-H13N9

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

NA_A-H17N10

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

NA_A-H18N11

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

NA_A-H1N1

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

NA_A-H2N2

Docking Scores:
-6.79 -6.60 -6.65
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N2

Docking Scores:
-6.43 -6.57
Similarity Score:
N/A
Best Match:
N/A

NA_A-H3N8

Docking Scores:
-6.53 -6.72 -6.75
Similarity Score:
14.21%
Best Match:
CHEMBL4285767

NA_A-H5N1

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

NA_A-H7N9

Docking Scores:
-6.73 -6.50 -6.86
Similarity Score:
N/A
Best Match:
N/A

NA_INFB

Docking Scores:
-6.45 -6.90
Similarity Score:
18.23%
Best Match:
CHEMBL4175983

NP_9ADNV

Docking Scores:
-4.31 -7.62
Similarity Score:
N/A
Best Match:
N/A

NP_A-H1N1

Docking Scores:
-6.22 -7.52 -5.60
Similarity Score:
N/A
Best Match:
N/A

NP_A-H5N1

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

NP_EBOZM

Docking Scores:
-6.57 -5.27 -6.05
Similarity Score:
N/A
Best Match:
N/A

NP_HCoV-NL63

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

NP_HCoV-OC43

Docking Scores:
-8.12 -7.61 -6.93
Similarity Score:
21.37%
Best Match:
CHEMBL3233481

NP_INFB

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

NP_INFD

Docking Scores:
-5.00
Similarity Score:
N/A
Best Match:
N/A

NP_LASSJ

Docking Scores:
-8.38 -9.18 -4.39
Similarity Score:
N/A
Best Match:
N/A

NP_SARS

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

NS1_9CALI

Docking Scores:
-5.95 -5.27 -5.67
Similarity Score:
N/A
Best Match:
N/A

NS1_9FLAV

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

NS1_DEN1W

Docking Scores:
-4.70
Similarity Score:
N/A
Best Match:
N/A

NS1_ZIKV

Docking Scores:
-8.18 -6.28 -6.42
Similarity Score:
N/A
Best Match:
N/A

NS2A_9FLAV

Docking Scores:
-4.09
Similarity Score:
N/A
Best Match:
N/A

NS2B_DEN1W

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

NS2B_DEN2P

Docking Scores:
-6.99 -6.65
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKV

Docking Scores:
-6.39 -6.09
Similarity Score:
N/A
Best Match:
N/A

NS2B_ZIKVF

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

NS3_9FLAV

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

NS3_DEN4T

Docking Scores:
-7.17 -7.24
Similarity Score:
N/A
Best Match:
N/A

NS3_HCV1A

Docking Scores:
-7.24 -5.41 -5.81
Similarity Score:
31.47%
Best Match:
CHEMBL3984600

NS3_HCV1B

Docking Scores:
-5.88 -6.07 -5.72
Similarity Score:
19.13%
Best Match:
CHEMBL3125634

NS3_HCV3A

Docking Scores:
-6.72 -6.73 -6.00
Similarity Score:
N/A
Best Match:
N/A

NS3_ZIKV

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

NS5B_HCV1A

Docking Scores:
-7.51 -7.44 -7.52
Similarity Score:
24.19%
Best Match:
CHEMBL3644912

NS5B_HCV1B

Docking Scores:
-7.45 -7.48 -6.12
Similarity Score:
31.10%
Best Match:
CHEMBL3645184

NS5B_HCV2A

Docking Scores:
-8.28 -8.40
Similarity Score:
27.39%
Best Match:
CHEMBL3127326

NS5_9FLAV

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

NS5_DEN3S

Docking Scores:
-6.58 -6.79
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKV

Docking Scores:
-7.13 -5.11
Similarity Score:
N/A
Best Match:
N/A

NS5_ZIKVF

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

NS6_9CALI

Docking Scores:
-5.01 -5.31 -5.79
Similarity Score:
N/A
Best Match:
N/A

NSP15_SARS

Docking Scores:
-5.34
Similarity Score:
21.21%
Best Match:
CHEMBL2441745

NSP15_SARS2

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

NSP1_INFB

Docking Scores:
-5.57 -5.66
Similarity Score:
N/A
Best Match:
N/A

NSP1_SARS

Docking Scores:
-5.76
Similarity Score:
21.21%
Best Match:
CHEMBL2441745

NSP3_HCoV-229E

Docking Scores:
-8.71
Similarity Score:
N/A
Best Match:
N/A

NSP3_IBV

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

NSP3_MHV

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

NSP3_SARS2

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

NSP9_HCoV-229E

Docking Scores:
-6.90 -5.79
Similarity Score:
N/A
Best Match:
N/A

PA_A-H17N10

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

PA_A-H1N1

Docking Scores:
-6.87 -6.92 -7.11
Similarity Score:
N/A
Best Match:
N/A

PA_A-H5N1

Docking Scores:
-7.04 -6.89 -6.90
Similarity Score:
N/A
Best Match:
N/A

PA_INFA

Docking Scores:
-8.27 -6.59 -6.64
Similarity Score:
30.71%
Best Match:
CHEMBL2040554

PA_INFB

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

PB2_A-H3N2

Docking Scores:
-7.39 -7.79
Similarity Score:
N/A
Best Match:
N/A

PB2_A-H5N1

Docking Scores:
-7.06 -6.80 -7.65
Similarity Score:
N/A
Best Match:
N/A

PB2_INFB

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

PB3_A-H3N2

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

PB4_A-H3N2

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

PLP_SARS

Docking Scores:
-7.06 -8.34 -7.06
Similarity Score:
29.86%
Best Match:
CHEMBL358279

PLP_SARS2

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

PM_9VIRU

Docking Scores:
-6.81 -6.98
Similarity Score:
N/A
Best Match:
N/A

PR_FCoV

Docking Scores:
-6.63
Similarity Score:
19.54%
Best Match:
CHEMBL4214471

PR_HCoV-229E

Docking Scores:
-6.28 -6.50
Similarity Score:
N/A
Best Match:
N/A

PR_HCoV-NL63

Docking Scores:
-5.12 -6.37
Similarity Score:
N/A
Best Match:
N/A

PR_HIV1

Docking Scores:
-6.39 -6.49 -5.71
Similarity Score:
20.43%
Best Match:
CHEMBL510485

PR_HIV2

Docking Scores:
-7.11 -6.01
Similarity Score:
N/A
Best Match:
N/A

PR_HKU1

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

PR_HKU4

Docking Scores:
-6.61 -6.96 -6.66
Similarity Score:
N/A
Best Match:
N/A

PR_IBV

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

PR_MERs

Docking Scores:
-7.10 -6.11
Similarity Score:
N/A
Best Match:
N/A

PR_PEDV

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

PR_SARS

Docking Scores:
-5.74 -6.18 -7.69
Similarity Score:
21.21%
Best Match:
CHEMBL2441745

PR_SARS2

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

PR_TGEV

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

P_9CALI

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

P_NVN68

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

RDRP_SARS2

Docking Scores:
-6.22
Similarity Score:
15.07%
Best Match:
CHEMBL4065616

RT_HIV1

Docking Scores:
-9.81 -9.78 -9.95
Similarity Score:
34.07%
Best Match:
CHEMBL4227382

SPIKE_HCoV-229E

Docking Scores:
-4.75
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-NL63

Docking Scores:
-4.70
Similarity Score:
N/A
Best Match:
N/A

SPIKE_HCoV-OC43

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

SPIKE_HKU4

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

SPIKE_IBV

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

SPIKE_MERs

Docking Scores:
-6.67 -5.59 -5.01
Similarity Score:
N/A
Best Match:
N/A

SPIKE_MHV

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

SPIKE_PDCoV

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

SPIKE_SARS

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

SPIKE_SARS2

Docking Scores:
-6.02 -5.45 -5.56
Similarity Score:
N/A
Best Match:
N/A

VP1_9CALI

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

VP1_NVN68

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

VP24_EBORE

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

VP24_EBOSU

Docking Scores:
-4.47
Similarity Score:
N/A
Best Match:
N/A

VP24_EBOZM

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

VP30_9MONO

Docking Scores:
-5.67
Similarity Score:
N/A
Best Match:
N/A

VP30_EBOZ5

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

VP30_EBOZM

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

VP35_EBORR

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

VP35_EBOZM

Docking Scores:
-5.94 -6.18 -6.16
Similarity Score:
N/A
Best Match:
N/A

VP40_EBOZM

Docking Scores:
-5.60 -5.19
Similarity Score:
N/A
Best Match:
N/A