Henry mini project #545 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match
Model 1 Model 2 Model 3
2A_HE71 Genome polyprotein -7.49 N/A N/A N/A N/A
2A_HE71M Genome polyprotein -7.51 N/A N/A N/A N/A
2C_HE71 Genome polyprotein -5.41 -6.27 N/A N/A N/A
3A_9ENTO Genome polyprotein -5.95 N/A N/A N/A N/A
3A_HE71M Genome polyprotein -5.50 N/A N/A N/A N/A
3A_HED68 Genome polyprotein -5.78 N/A N/A N/A N/A
3C_HE71 Genome polyprotein -5.88 -6.25 N/A N/A N/A
3C_HED68 Genome polyprotein -5.47 N/A N/A N/A N/A
3D_HE71 Genome polyprotein -7.52 N/A N/A N/A N/A
3D_HED68 Genome polyprotein -7.33 N/A N/A N/A N/A
ACE2_HUMAN angiotensin converting enzyme 2 -9.09 N/A N/A 21.43% CHEMBL429844
CAPSD_9CALI Capsid protein -7.01 -6.94 -7.75 N/A N/A
CAPSD_9ENTO Genome polyprotein -8.98 N/A N/A N/A N/A
CAPSD_DEN2P Genome polyprotein -5.67 N/A N/A N/A N/A
CAPSD_HCV77 Genome polyprotein -4.44 N/A N/A 41.77% CHEMBL3696815
CAPSD_HED68 Capsid protein VP0 -7.55 -7.96 N/A N/A N/A
CAPSD_ZIKV Core protein -5.90 -5.24 N/A N/A N/A
DPM_HHV1K DNA polymerase catalytic subunit -7.73 N/A N/A 17.36% CHEMBL479371
E1_9HEPC Envelope glycoprotein E1 -5.28 N/A N/A N/A N/A
E1_HCV77 Genome polyprotein -3.96 N/A N/A 41.77% CHEMBL3696815
E1_HCVJ1 Genome polyprotein -4.64 N/A N/A N/A N/A
E2_9HEPC Core protein precursor -8.23 N/A N/A N/A N/A
E2_HCV77 Genome polyprotein -6.10 N/A N/A 41.77% CHEMBL3696815
ENV_9FLAV Envelope protein E -5.47 N/A N/A N/A N/A
ENV_DEN1B Genome polyprotein -4.79 N/A N/A N/A N/A
ENV_DEN2P Genome polyprotein -6.51 N/A N/A N/A N/A
ENV_DEN3P Genome polyprotein -5.58 N/A N/A N/A N/A
ENV_HHV2H Envelope glycoprotein H -6.23 N/A N/A N/A N/A
ENV_ZIKV Core protein -5.83 N/A N/A N/A N/A
ENV_ZIKVK Genome polyprotein -5.96 N/A N/A N/A N/A
G1_ADNV Envelope polyprotein -4.09 -6.30 -5.95 N/A N/A
G2_ADNV Envelope polyprotein -8.24 -7.79 -6.92 N/A N/A
GB_HHV11 Envelope glycoprotein B -6.38 N/A N/A N/A N/A
GB_HHV1K Envelope glycoprotein B -6.64 -6.60 N/A N/A N/A
GD_9ALPH Glycoprotein D -6.87 -6.25 N/A N/A N/A
GD_HHV1 Glycoprotein D -6.14 N/A N/A N/A N/A
GP160_HIV1 Envelope glycoprotein gp160 -6.32 -6.36 -6.27 N/A N/A
GP160_HIV2 Envelope glycoprotein gp160 -6.86 N/A N/A N/A N/A
GP_EBOV Envelope glycoprotein -7.17 -6.29 -6.20 19.27% CHEMBL3125895
GP_LASSJ Pre-glycoprotein polyprotein GP complex -6.42 -6.85 N/A N/A N/A
HA_A-H10N7 Hemagglutinin -6.68 N/A N/A N/A N/A
HA_A-H10N8 Hemagglutinin -5.51 N/A N/A N/A N/A
HA_A-H13N6 Hemagglutinin -6.69 N/A N/A N/A N/A
HA_A-H14N6 Hemagglutinin -7.36 N/A N/A N/A N/A
HA_A-H15N9 Hemagglutinin -6.64 N/A N/A N/A N/A
HA_A-H17N10 Hemagglutinin -5.90 N/A N/A N/A N/A
HA_A-H18N11 Hemagglutinin -5.68 N/A N/A N/A N/A
HA_A-H1N1 Hemagglutinin -6.67 -6.23 N/A N/A N/A
HA_A-H2N2 Hemagglutinin -6.29 -6.41 N/A N/A N/A
HA_A-H3N2 Hemagglutinin -5.81 -5.95 -6.05 N/A N/A
HA_A-H3N8 Hemagglutinin -5.74 -6.13 -5.82 N/A N/A
HA_A-H5N1 Hemagglutinin -6.72 -6.96 -6.22 N/A N/A
HA_A-H5N3 Hemagglutinin -7.15 -6.40 N/A N/A N/A
HA_A-H6N1 Hemagglutinin -5.51 N/A N/A N/A N/A
HA_A-H6N6 Hemagglutinin -6.41 N/A N/A N/A N/A
HA_A-H7N2 Hemagglutinin -6.49 -5.92 -6.26 N/A N/A
HA_A-H7N7 Hemagglutinin -6.07 -6.60 N/A N/A N/A
HA_A-H7N9 Hemagglutinin -6.23 N/A N/A N/A N/A
HA_INFB Hemagglutinin -6.07 -6.41 N/A N/A N/A
HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.07 N/A N/A N/A N/A
HE_BCV Hemagglutinin-esterase -5.96 -6.09 N/A N/A N/A
HE_HCoV-OC43 Hemagglutinin-esterase -5.29 N/A N/A N/A N/A
HE_MHV Hemagglutinin-esterase -5.57 N/A N/A N/A N/A
IN_HIV1 Gag-Pol polyprotein -5.36 -5.32 N/A N/A N/A
MD_HKU4 Replicase polyprotein 1ab -8.78 -8.39 -8.01 N/A N/A
MD_MERs Replicase polyprotein 1a -8.67 -8.19 N/A N/A N/A
MEM_9FLAV Core protein -5.46 N/A N/A N/A N/A
MTASE_SARS2 Methyltransferase -5.93 N/A N/A N/A N/A
MTASE_SARS2 Methyltransferase -7.65 N/A N/A N/A N/A
MX2_A-H5N1 Matrix protein 2 -8.80 N/A N/A N/A N/A
MX_9MONO Matrix protein VP40 -7.66 N/A N/A N/A N/A
MX_LASSJ RING finger protein Z -5.70 N/A N/A N/A N/A
NA_A-H11N6 Neuraminidase -7.63 -7.38 -7.63 N/A N/A
NA_A-H11N9 Neuraminidase -6.00 -7.51 -7.55 N/A N/A
NA_A-H12N5 Neuraminidase -7.31 -7.85 -7.62 N/A N/A
NA_A-H13N9 Neuraminidase -6.51 N/A N/A N/A N/A
NA_A-H17N10 Neuraminidase -6.60 N/A N/A N/A N/A
NA_A-H18N11 Neuraminidase -5.99 N/A N/A N/A N/A
NA_A-H1N1 Neuraminidase -7.28 N/A N/A N/A N/A
NA_A-H2N2 Neuraminidase -7.71 -7.29 -7.29 N/A N/A
NA_A-H3N2 Ig heavy chain Mem5 -6.59 -7.31 N/A N/A N/A
NA_A-H3N8 Neuraminidase -7.73 -7.75 -7.38 22.31% CHEMBL222813
NA_A-H5N1 Neuraminidase -7.42 N/A N/A N/A N/A
NA_A-H7N9 Neuraminidase -7.14 -7.24 -7.34 N/A N/A
NA_INFB Neuraminidase -7.79 -7.76 N/A 28.81% CHEMBL183817
NP_9ADNV Nucleoprotein -5.19 -7.30 N/A N/A N/A
NP_A-H1N1 Nucleoprotein -5.40 -5.82 -7.17 N/A N/A
NP_A-H5N1 Nucleoprotein -6.33 N/A N/A N/A N/A
NP_EBOZM Nucleoprotein -5.57 -5.85 -6.31 N/A N/A
NP_HCoV-NL63 Nucleoprotein -6.43 N/A N/A N/A N/A
NP_HCoV-OC43 Nucleoprotein -7.18 -6.86 -6.53 11.54% CHEMBL3233481
NP_INFB Nucleoprotein -5.82 N/A N/A N/A N/A
NP_INFD NP -5.11 N/A N/A N/A N/A
NP_LASSJ Nucleoprotein -8.49 -8.45 -4.97 N/A N/A
NP_SARS Nucleoprotein -6.64 N/A N/A N/A N/A
NS1_9CALI NTPase -5.36 -5.49 -6.26 N/A N/A
NS1_9FLAV Non-structural protein 1 -5.50 N/A N/A N/A N/A
NS1_DEN1W Genome polyprotein -5.46 N/A N/A N/A N/A
NS1_ZIKV Core protein -6.60 -6.35 -6.61 N/A N/A
NS2A_9FLAV Core protein -4.11 N/A N/A N/A N/A
NS2B_DEN1W Genome polyprotein -6.90 N/A N/A N/A N/A
NS2B_DEN2P Genome polyprotein -6.79 -6.77 N/A N/A N/A
NS2B_ZIKV Genome polyprotein -6.70 -6.77 N/A N/A N/A
NS2B_ZIKVF Genome polyprotein -6.65 N/A N/A N/A N/A
NS3_9FLAV Core protein -7.57 N/A N/A N/A N/A
NS3_DEN4T Genome polyprotein -8.03 -6.94 N/A N/A N/A
NS3_HCV1A Genome polyprotein -8.08 -5.97 -7.11 41.77% CHEMBL3696815
NS3_HCV1B Genome polyprotein -7.79 -7.13 -5.79 20.82% CHEMBL3954962
NS3_HCV3A Genome polyprotein -6.73 -6.73 -7.01 N/A N/A
NS3_ZIKV Genome polyprotein -7.72 N/A N/A N/A N/A
NS5B_HCV1A Genome polyprotein -7.43 -7.12 -7.08 21.98% CHEMBL3644925
NS5B_HCV1B Genome polyprotein -6.91 -7.88 -7.48 22.18% CHEMBL3970609
NS5B_HCV2A Genome polyprotein -8.92 -8.21 N/A 16.00% CHEMBL3127326
NS5_9FLAV Core protein -8.00 N/A N/A N/A N/A
NS5_DEN3S Genome polyprotein -7.11 -7.87 N/A N/A N/A
NS5_ZIKV Genome polyprotein -7.81 -5.25 N/A N/A N/A
NS5_ZIKVF Genome polyprotein -7.24 N/A N/A N/A N/A
NS6_9CALI NTPase -4.75 -5.70 -5.87 N/A N/A
NSP15_SARS Replicase polyprotein 1ab -6.07 N/A N/A 18.10% CHEMBL2441745
NSP15_SARS2 Replicase polyprotein 1ab -6.83 N/A N/A N/A N/A
NSP1_INFB Non-structural protein 1 -5.57 -5.26 N/A N/A N/A
NSP1_SARS Replicase polyprotein 1ab -5.87 N/A N/A 18.10% CHEMBL2441745
NSP3_HCoV-229E Replicase polyprotein 1a -9.71 N/A N/A N/A N/A
NSP3_IBV Replicase polyprotein 1a -9.52 N/A N/A N/A N/A
NSP3_MHV Replicase polyprotein 1ab -6.14 N/A N/A N/A N/A
NSP3_SARS2 Replicase polyprotein 1ab -6.92 N/A N/A N/A N/A
NSP9_HCoV-229E Replicase polyprotein 1ab -6.64 -6.23 N/A N/A N/A
PA_A-H17N10 Polymerase acidic protein -7.99 N/A N/A N/A N/A
PA_A-H1N1 Polymerase acidic protein -7.73 -7.95 -8.26 N/A N/A
PA_A-H5N1 Polymerase acidic protein -8.19 -7.94 -7.88 N/A N/A
PA_INFA Polymerase acidic protein -7.32 -8.08 -7.92 24.75% CHEMBL3944613
PA_INFB Polymerase acidic protein -7.16 N/A N/A N/A N/A
PB2_A-H3N2 Polymerase basic protein 2 -6.75 -7.37 N/A N/A N/A
PB2_A-H5N1 Polymerase basic protein 2 -6.84 -6.68 -7.11 N/A N/A
PB2_INFB Polymerase basic protein 2 -7.04 N/A N/A N/A N/A
PB3_A-H3N2 Polymerase basic protein 2 -7.40 N/A N/A N/A N/A
PB4_A-H3N2 Polymerase basic protein 2 -7.07 N/A N/A N/A N/A
PLP_SARS Replicase polyprotein 1a -7.99 -7.86 -8.13 20.66% CHEMBL213054
PLP_SARS2 papain-like protease -7.28 N/A N/A N/A N/A
PM_9VIRU RNA-directed RNA polymerase L -7.17 -7.13 N/A N/A N/A
PR_FCoV Replicase polyprotein 1ab -6.62 N/A N/A 17.44% CHEMBL4214066
PR_HCoV-229E Replicase polyprotein 1a -7.68 -7.20 N/A N/A N/A
PR_HCoV-NL63 Replicase polyprotein 1a -5.00 -7.44 N/A N/A N/A
PR_HIV1 Gag-Pol polyprotein -6.03 -6.15 -6.17 28.51% CHEMBL3645127
PR_HIV2 Gag-Pol polyprotein -6.65 -5.98 N/A N/A N/A
PR_HKU1 Replicase polyprotein 1a -6.67 N/A N/A N/A N/A
PR_HKU4 Replicase polyprotein 1ab -7.18 -6.89 -6.44 N/A N/A
PR_IBV Replicase polyprotein 1a -7.31 N/A N/A N/A N/A
PR_MERs 3C-like proteinase -7.31 -6.86 N/A N/A N/A
PR_PEDV 3C-like proteinase -6.92 N/A N/A N/A N/A
PR_SARS Replicase polyprotein 1ab -6.90 -7.30 -7.27 18.10% CHEMBL2441745
PR_SARS2 3C-like protease -7.31 N/A N/A N/A N/A
PR_TGEV Replicase polyprotein 1a -6.40 N/A N/A N/A N/A
P_9CALI Norovirus P domain protein -7.56 N/A N/A N/A N/A
P_NVN68 Capsid protein VP1 -5.32 N/A N/A N/A N/A
RDRP_SARS2 RNA-dependent RNA polymerase -6.76 N/A N/A 23.68% CHEMBL4065616
RT_HIV1 Gag-Pol polyprotein -7.85 -8.20 -7.88 23.95% CHEMBL3683704
SPIKE_HCoV-229E Spike glycoprotein -4.73 N/A N/A N/A N/A
SPIKE_HCoV-NL63 Spike glycoprotein -5.14 N/A N/A N/A N/A
SPIKE_HCoV-OC43 Spike glycoprotein -6.44 N/A N/A N/A N/A
SPIKE_HKU4 Spike glycoprotein -7.35 N/A N/A N/A N/A
SPIKE_IBV Spike glycoprotein -5.41 N/A N/A N/A N/A
SPIKE_MERs Spike glycoprotein -6.43 -5.90 -5.33 N/A N/A
SPIKE_MHV Spike glycoprotein -7.00 N/A N/A N/A N/A
SPIKE_PDCoV Spike protein -6.17 N/A N/A N/A N/A
SPIKE_SARS Spike glycoprotein -5.92 -6.70 N/A N/A N/A
SPIKE_SARS2 Spike glycoprotein -5.51 -5.83 -6.13 N/A N/A
VP1_9CALI Capsid protein -7.74 N/A N/A N/A N/A
VP1_NVN68 Capsid protein VP1 -6.11 N/A N/A N/A N/A
VP24_EBORE Membrane-associated protein VP24 -4.87 N/A N/A N/A N/A
VP24_EBOSU Membrane-associated protein VP24 -4.79 N/A N/A N/A N/A
VP24_EBOZM Membrane-associated protein VP24 -5.32 N/A N/A N/A N/A
VP30_9MONO Minor nucleoprotein VP30 -5.18 N/A N/A N/A N/A
VP30_EBOZ5 Transcriptional activator VP30 -6.22 N/A N/A N/A N/A
VP30_EBOZM Transcriptional activator VP30 -6.54 N/A N/A N/A N/A
VP35_EBORR Polymerase cofactor VP35 -5.52 N/A N/A N/A N/A
VP35_EBOZM Polymerase cofactor VP35 -5.60 -6.02 -5.41 N/A N/A
VP40_EBOZM Matrix protein VP40 -4.82 -4.99 N/A N/A N/A