Test #570 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 -5.52 N/A N/A N/A N/A
2A_HE71M Genome polyprotein -5.51 N/A N/A N/A N/A
2C_HE71 Genome polyprotein -4.51 -4.79 N/A N/A N/A
3A_9ENTO Genome polyprotein -4.61 N/A N/A N/A N/A
3A_HE71M Genome polyprotein -4.39 N/A N/A N/A N/A
3A_HED68 Genome polyprotein -3.92 N/A N/A N/A N/A
3C_HE71 Genome polyprotein -4.51 -5.61 N/A N/A N/A
3C_HED68 Genome polyprotein -4.20 N/A N/A N/A N/A
3D_HE71 Genome polyprotein -5.17 N/A N/A N/A N/A
3D_HED68 Genome polyprotein -5.39 N/A N/A N/A N/A
ACE2_HUMAN angiotensin converting enzyme 2 -6.58 N/A N/A 31.31% CHEMBL437595
CAPSD_9CALI Capsid protein -5.14 -6.29 -6.04 N/A N/A
CAPSD_9ENTO Genome polyprotein -6.53 N/A N/A N/A N/A
CAPSD_DEN2P Genome polyprotein -5.20 N/A N/A N/A N/A
CAPSD_HCV77 Genome polyprotein -3.56 N/A N/A 30.39% CHEMBL4107639
CAPSD_HED68 Capsid protein VP0 -6.25 -6.18 N/A N/A N/A
CAPSD_ZIKV Core protein -5.26 -4.75 N/A N/A N/A
DPM_HHV1K DNA polymerase catalytic subunit -5.63 N/A N/A 12.50% CHEMBL479371
E1_9HEPC Envelope glycoprotein E1 -4.14 N/A N/A N/A N/A
E1_HCV77 Genome polyprotein -3.98 N/A N/A 30.39% CHEMBL4107639
E1_HCVJ1 Genome polyprotein -3.62 N/A N/A N/A N/A
E2_9HEPC Core protein precursor -6.10 N/A N/A N/A N/A
E2_HCV77 Genome polyprotein -4.45 N/A N/A 30.39% CHEMBL4107639
ENV_9FLAV Envelope protein E -4.20 N/A N/A N/A N/A
ENV_DEN1B Genome polyprotein -4.39 N/A N/A N/A N/A
ENV_DEN2P Genome polyprotein -5.31 N/A N/A N/A N/A
ENV_DEN3P Genome polyprotein -4.86 N/A N/A N/A N/A
ENV_HHV2H Envelope glycoprotein H -5.06 N/A N/A N/A N/A
ENV_ZIKV Core protein -4.76 N/A N/A N/A N/A
ENV_ZIKVK Genome polyprotein -4.51 N/A N/A N/A N/A
G1_ADNV Envelope polyprotein -3.46 -5.08 -5.02 N/A N/A
G2_ADNV Envelope polyprotein -6.22 -5.96 -4.51 N/A N/A
GB_HHV11 Envelope glycoprotein B -5.07 N/A N/A N/A N/A
GB_HHV1K Envelope glycoprotein B -5.84 -5.59 N/A N/A N/A
GD_9ALPH Glycoprotein D -4.89 -4.98 N/A N/A N/A
GD_HHV1 Glycoprotein D -4.73 N/A N/A N/A N/A
GP160_HIV1 Envelope glycoprotein gp160 -5.50 -6.70 -6.31 N/A N/A
GP160_HIV2 Envelope glycoprotein gp160 -5.10 N/A N/A N/A N/A
GP_EBOV Envelope glycoprotein -5.55 -5.14 -5.27 25.51% CHEMBL1655
GP_LASSJ Pre-glycoprotein polyprotein GP complex -4.97 -5.02 N/A N/A N/A
HA_A-H10N7 Hemagglutinin -5.13 N/A N/A N/A N/A
HA_A-H10N8 Hemagglutinin -4.94 N/A N/A N/A N/A
HA_A-H13N6 Hemagglutinin -5.00 N/A N/A N/A N/A
HA_A-H14N6 Hemagglutinin -4.72 N/A N/A N/A N/A
HA_A-H15N9 Hemagglutinin -5.07 N/A N/A N/A N/A
HA_A-H17N10 Hemagglutinin -4.32 N/A N/A N/A N/A
HA_A-H18N11 Hemagglutinin -4.23 N/A N/A N/A N/A
HA_A-H1N1 Hemagglutinin -5.43 -4.59 N/A N/A N/A
HA_A-H2N2 Hemagglutinin -4.43 -4.60 N/A N/A N/A
HA_A-H3N2 Hemagglutinin -4.82 -4.74 -4.38 N/A N/A
HA_A-H3N8 Hemagglutinin -4.22 -4.69 -4.62 N/A N/A
HA_A-H5N1 Hemagglutinin -5.25 -5.89 -5.61 N/A N/A
HA_A-H5N3 Hemagglutinin -5.26 -5.05 N/A N/A N/A
HA_A-H6N1 Hemagglutinin -4.94 N/A N/A N/A N/A
HA_A-H6N6 Hemagglutinin -4.70 N/A N/A N/A N/A
HA_A-H7N2 Hemagglutinin -5.16 -4.64 -4.85 N/A N/A
HA_A-H7N7 Hemagglutinin -4.94 -5.10 N/A N/A N/A
HA_A-H7N9 Hemagglutinin -4.73 N/A N/A N/A N/A
HA_INFB Hemagglutinin -4.77 -4.78 N/A N/A N/A
HA_INFD Hemagglutinin-esterase-fusion glycoprotein -4.22 N/A N/A N/A N/A
HE_BCV Hemagglutinin-esterase -6.19 -5.43 N/A N/A N/A
HE_HCoV-OC43 Hemagglutinin-esterase -4.48 N/A N/A N/A N/A
HE_MHV Hemagglutinin-esterase -4.56 N/A N/A N/A N/A
IN_HIV1 Gag-Pol polyprotein -4.08 -3.97 N/A N/A N/A
MD_HKU4 Replicase polyprotein 1ab -6.76 -6.45 -6.53 N/A N/A
MD_MERs Replicase polyprotein 1a -6.54 -6.53 N/A N/A N/A
MEM_9FLAV Core protein -4.22 N/A N/A N/A N/A
MTASE_SARS2 Methyltransferase -5.09 N/A N/A N/A N/A
MTASE_SARS2 Methyltransferase -5.44 N/A N/A N/A N/A
MX2_A-H5N1 Matrix protein 2 -6.32 N/A N/A N/A N/A
MX_9MONO Matrix protein VP40 -5.69 N/A N/A N/A N/A
MX_LASSJ RING finger protein Z -4.46 N/A N/A N/A N/A
NA_A-H11N6 Neuraminidase -5.30 -5.51 -5.41 N/A N/A
NA_A-H11N9 Neuraminidase -6.08 -5.55 -5.48 N/A N/A
NA_A-H12N5 Neuraminidase -5.99 -5.53 -5.41 N/A N/A
NA_A-H13N9 Neuraminidase -5.63 N/A N/A N/A N/A
NA_A-H17N10 Neuraminidase -5.07 N/A N/A N/A N/A
NA_A-H18N11 Neuraminidase -4.49 N/A N/A N/A N/A
NA_A-H1N1 Neuraminidase -6.28 N/A N/A N/A N/A
NA_A-H2N2 Neuraminidase -5.70 -5.30 -5.47 N/A N/A
NA_A-H3N2 Ig heavy chain Mem5 -4.63 -5.18 N/A N/A N/A
NA_A-H3N8 Neuraminidase -5.39 -5.98 -5.31 18.06% CHEMBL4285767
NA_A-H5N1 Neuraminidase -5.98 N/A N/A N/A N/A
NA_A-H7N9 Neuraminidase -5.39 -5.54 -5.26 N/A N/A
NA_INFB Neuraminidase -5.50 -5.74 N/A 20.28% CHEMBL81286
NP_9ADNV Nucleoprotein -4.05 -6.19 N/A N/A N/A
NP_A-H1N1 Nucleoprotein -5.14 -5.66 -5.64 N/A N/A
NP_A-H5N1 Nucleoprotein -5.46 N/A N/A N/A N/A
NP_EBOZM Nucleoprotein -4.66 -4.60 -4.63 N/A N/A
NP_HCoV-NL63 Nucleoprotein -4.61 N/A N/A N/A N/A
NP_HCoV-OC43 Nucleoprotein -6.49 -6.01 -5.71 9.09% CHEMBL3233481
NP_INFB Nucleoprotein -3.90 N/A N/A N/A N/A
NP_INFD NP -4.02 N/A N/A N/A N/A
NP_LASSJ Nucleoprotein -6.53 -6.86 -3.65 N/A N/A
NP_SARS Nucleoprotein -4.95 N/A N/A N/A N/A
NS1_9CALI NTPase -4.87 -4.65 -4.79 N/A N/A
NS1_9FLAV Non-structural protein 1 -5.46 N/A N/A N/A N/A
NS1_DEN1W Genome polyprotein -4.28 N/A N/A N/A N/A
NS1_ZIKV Core protein -6.07 -5.81 -4.92 N/A N/A
NS2A_9FLAV Core protein -4.06 N/A N/A N/A N/A
NS2B_DEN1W Genome polyprotein -4.86 N/A N/A N/A N/A
NS2B_DEN2P Genome polyprotein -5.74 -4.99 N/A N/A N/A
NS2B_ZIKV Genome polyprotein -5.77 -5.11 N/A N/A N/A
NS2B_ZIKVF Genome polyprotein -5.82 N/A N/A N/A N/A
NS3_9FLAV Core protein -5.63 N/A N/A N/A N/A
NS3_DEN4T Genome polyprotein -6.21 -6.07 N/A N/A N/A
NS3_HCV1A Genome polyprotein -5.03 -5.04 -5.58 30.39% CHEMBL4107639
NS3_HCV1B Genome polyprotein -5.38 -5.26 -5.00 17.05% CHEMBL1170408
NS3_HCV3A Genome polyprotein -5.42 -5.34 -5.46 N/A N/A
NS3_ZIKV Genome polyprotein -5.66 N/A N/A N/A N/A
NS5B_HCV1A Genome polyprotein -5.57 -6.00 -6.00 26.79% CHEMBL446360
NS5B_HCV1B Genome polyprotein -5.61 -6.05 -5.96 15.59% CHEMBL3645203
NS5B_HCV2A Genome polyprotein -6.26 -6.27 N/A 18.57% CHEMBL3127326
NS5_9FLAV Core protein -5.64 N/A N/A N/A N/A
NS5_DEN3S Genome polyprotein -5.02 -5.71 N/A N/A N/A
NS5_ZIKV Genome polyprotein -5.96 -4.31 N/A N/A N/A
NS5_ZIKVF Genome polyprotein -5.73 N/A N/A N/A N/A
NS6_9CALI NTPase -3.65 -4.86 -4.62 N/A N/A
NSP15_SARS Replicase polyprotein 1ab -5.08 N/A N/A 20.77% CHEMBL2441741
NSP15_SARS2 Replicase polyprotein 1ab -5.48 N/A N/A N/A N/A
NSP1_INFB Non-structural protein 1 -4.46 -4.29 N/A N/A N/A
NSP1_SARS Replicase polyprotein 1ab -4.63 N/A N/A 20.77% CHEMBL2441741
NSP3_HCoV-229E Replicase polyprotein 1a -6.36 N/A N/A N/A N/A
NSP3_IBV Replicase polyprotein 1a -6.54 N/A N/A N/A N/A
NSP3_MHV Replicase polyprotein 1ab -5.13 N/A N/A N/A N/A
NSP3_SARS2 Replicase polyprotein 1ab -5.50 N/A N/A N/A N/A
NSP9_HCoV-229E Replicase polyprotein 1ab -5.37 -5.62 N/A N/A N/A
PA_A-H17N10 Polymerase acidic protein -5.01 N/A N/A N/A N/A
PA_A-H1N1 Polymerase acidic protein -5.35 -5.53 -5.08 N/A N/A
PA_A-H5N1 Polymerase acidic protein -5.51 -5.37 -5.26 N/A N/A
PA_INFA Polymerase acidic protein -6.71 -4.88 -5.11 45.68% CHEMBL3600947
PA_INFB Polymerase acidic protein -5.01 N/A N/A N/A N/A
PB2_A-H3N2 Polymerase basic protein 2 -5.35 -5.82 N/A N/A N/A
PB2_A-H5N1 Polymerase basic protein 2 -5.32 -5.35 -5.70 N/A N/A
PB2_INFB Polymerase basic protein 2 -5.78 N/A N/A N/A N/A
PB3_A-H3N2 Polymerase basic protein 2 -5.68 N/A N/A N/A N/A
PB4_A-H3N2 Polymerase basic protein 2 -5.76 N/A N/A N/A N/A
PLP_SARS Replicase polyprotein 1a -5.98 -6.27 -6.33 23.01% CHEMBL222735
PLP_SARS2 papain-like protease -4.64 N/A N/A N/A N/A
PM_9VIRU RNA-directed RNA polymerase L -5.17 -5.60 N/A N/A N/A
PR_FCoV Replicase polyprotein 1ab -4.72 N/A N/A 23.40% CHEMBL4214471
PR_HCoV-229E Replicase polyprotein 1a -4.72 -4.70 N/A N/A N/A
PR_HCoV-NL63 Replicase polyprotein 1a -4.64 -5.25 N/A N/A N/A
PR_HIV1 Gag-Pol polyprotein -4.73 -5.23 -5.22 20.25% CHEMBL510485
PR_HIV2 Gag-Pol polyprotein -5.64 -4.87 N/A N/A N/A
PR_HKU1 Replicase polyprotein 1a -4.71 N/A N/A N/A N/A
PR_HKU4 Replicase polyprotein 1ab -4.73 -5.08 -4.90 N/A N/A
PR_IBV Replicase polyprotein 1a -5.00 N/A N/A N/A N/A
PR_MERs 3C-like proteinase -4.89 -4.97 N/A N/A N/A
PR_PEDV 3C-like proteinase -4.78 N/A N/A N/A N/A
PR_SARS Replicase polyprotein 1ab -4.55 -5.10 -4.65 20.77% CHEMBL2441741
PR_SARS2 3C-like protease -4.86 N/A N/A N/A N/A
PR_TGEV Replicase polyprotein 1a -4.87 N/A N/A N/A N/A
P_9CALI Norovirus P domain protein -6.22 N/A N/A N/A N/A
P_NVN68 Capsid protein VP1 -4.56 N/A N/A N/A N/A
RDRP_SARS2 RNA-dependent RNA polymerase -5.56 N/A N/A 13.53% CHEMBL4065616
RT_HIV1 Gag-Pol polyprotein -6.54 -6.63 -6.59 24.24% CHEMBL3775172
SPIKE_HCoV-229E Spike glycoprotein -3.83 N/A N/A N/A N/A
SPIKE_HCoV-NL63 Spike glycoprotein -4.11 N/A N/A N/A N/A
SPIKE_HCoV-OC43 Spike glycoprotein -4.43 N/A N/A N/A N/A
SPIKE_HKU4 Spike glycoprotein -4.73 N/A N/A N/A N/A
SPIKE_IBV Spike glycoprotein -4.67 N/A N/A N/A N/A
SPIKE_MERs Spike glycoprotein -5.40 -4.86 -4.35 N/A N/A
SPIKE_MHV Spike glycoprotein -5.00 N/A N/A N/A N/A
SPIKE_PDCoV Spike protein -4.88 N/A N/A N/A N/A
SPIKE_SARS Spike glycoprotein -4.62 -5.65 N/A N/A N/A
SPIKE_SARS2 Spike glycoprotein -4.50 -4.66 -5.21 N/A N/A
VP1_9CALI Capsid protein -5.28 N/A N/A N/A N/A
VP1_NVN68 Capsid protein VP1 -4.10 N/A N/A N/A N/A
VP24_EBORE Membrane-associated protein VP24 -4.47 N/A N/A N/A N/A
VP24_EBOSU Membrane-associated protein VP24 -3.50 N/A N/A N/A N/A
VP24_EBOZM Membrane-associated protein VP24 -4.08 N/A N/A N/A N/A
VP30_9MONO Minor nucleoprotein VP30 -4.36 N/A N/A N/A N/A
VP30_EBOZ5 Transcriptional activator VP30 -5.09 N/A N/A N/A N/A
VP30_EBOZM Transcriptional activator VP30 -5.58 N/A N/A N/A N/A
VP35_EBORR Polymerase cofactor VP35 -4.36 N/A N/A N/A N/A
VP35_EBOZM Polymerase cofactor VP35 -4.80 -4.68 -4.79 N/A N/A
VP40_EBOZM Matrix protein VP40 -4.74 -4.46 N/A N/A N/A