Paritaprevir #129 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
GP160_HIV1 Envelope glycoprotein gp160 -7.88 -8.31 -7.63 N/A N/A
GP160_HIV2 Envelope glycoprotein gp160 -8.83 N/A N/A N/A N/A
GP_EBOV Envelope glycoprotein -9.87 -9.28 -9.51 39.82% CHEMBL3125899
HA_A-H10N7 Hemagglutinin -8.62 N/A N/A N/A N/A
HA_A-H10N8 Hemagglutinin -8.14 N/A N/A N/A N/A
HA_A-H13N6 Hemagglutinin -7.50 N/A N/A N/A N/A
HA_A-H14N6 Hemagglutinin -8.72 N/A N/A N/A N/A
HA_A-H15N9 Hemagglutinin -8.20 N/A N/A N/A N/A
HA_A-H17N10 Hemagglutinin -8.20 N/A N/A N/A N/A
HA_A-H18N11 Hemagglutinin -7.87 N/A N/A N/A N/A
HA_A-H1N1 Hemagglutinin -8.75 -8.69 N/A N/A N/A
HA_A-H2N2 Hemagglutinin -8.04 -8.05 N/A N/A N/A
HA_A-H3N2 Hemagglutinin -8.90 -8.56 -9.26 N/A N/A
HA_A-H3N8 Hemagglutinin -7.58 -7.70 -8.26 N/A N/A
HA_A-H5N1 Hemagglutinin -7.82 -7.45 -8.11 N/A N/A
HA_A-H5N3 Hemagglutinin -7.86 -7.40 N/A N/A N/A
HA_A-H6N1 Hemagglutinin -8.14 N/A N/A N/A N/A
HA_A-H6N6 Hemagglutinin -7.80 N/A N/A N/A N/A
HA_A-H7N2 Hemagglutinin -8.64 -7.63 -8.01 N/A N/A
HA_A-H7N7 Hemagglutinin -7.90 -8.18 N/A N/A N/A
HA_A-H7N9 Hemagglutinin -8.27 N/A N/A N/A N/A
HA_INFB Hemagglutinin -8.70 -7.79 N/A N/A N/A
HA_INFD Hemagglutinin-esterase-fusion glycoprotein -7.67 N/A N/A N/A N/A
HE_BCV Hemagglutinin-esterase -9.07 -7.98 N/A N/A N/A
HE_HCoV-OC43 Hemagglutinin-esterase -7.87 N/A N/A N/A N/A
HE_MHV Hemagglutinin-esterase -9.00 N/A N/A N/A N/A
IN_HIV1 Gag-Pol polyprotein -7.07 -8.25 N/A N/A N/A
MD_HKU4 Replicase polyprotein 1ab -8.00 -8.20 -8.25 N/A N/A
MD_MERs Replicase polyprotein 1a -9.12 -9.72 N/A N/A N/A
MX2_A-H5N1 Matrix protein 2 51.43 N/A N/A N/A N/A
NA_A-H11N6 Neuraminidase -8.91 -9.11 -9.43 N/A N/A
NA_A-H11N9 Neuraminidase -9.03 -10.42 -10.57 N/A N/A
NA_A-H12N5 Neuraminidase -9.25 -9.25 -10.01 N/A N/A
NA_A-H13N9 Neuraminidase -8.26 N/A N/A N/A N/A
NA_A-H17N10 Neuraminidase -9.59 N/A N/A N/A N/A
NA_A-H18N11 Neuraminidase -9.36 N/A N/A N/A N/A
NA_A-H1N1 Neuraminidase -10.13 N/A N/A N/A N/A
NA_A-H2N2 Neuraminidase -9.74 -10.52 -10.64 N/A N/A
NA_A-H3N2 Ig heavy chain Mem5 -9.33 -8.41 N/A N/A N/A
NA_A-H3N8 Neuraminidase -9.92 -10.94 -10.11 N/A N/A
NA_A-H5N1 Neuraminidase -9.68 N/A N/A N/A N/A
NA_A-H7N9 Neuraminidase -10.54 -9.96 -10.23 N/A N/A
NA_INFB Neuraminidase -7.58 -7.37 N/A 39.83% CHEMBL254679
NP_A-H1N1 Nucleoprotein -8.21 -7.94 -7.84 N/A N/A
NP_A-H5N1 Nucleoprotein -7.92 N/A N/A N/A N/A
NP_HCoV-NL63 Nucleoprotein -8.83 N/A N/A N/A N/A
NP_HCoV-OC43 Nucleoprotein -10.45 -9.35 -8.84 16.54% CHEMBL3233481
NP_INFB Nucleoprotein -6.95 N/A N/A N/A N/A
NP_INFD NP -6.71 N/A N/A N/A N/A
NP_SARS Nucleoprotein -8.23 N/A N/A N/A N/A
NS3_HCV1A Genome polyprotein -8.85 -8.17 -8.56 54.15% CHEMBL3645617
NS3_HCV1B Genome polyprotein -9.04 -8.71 -8.55 49.70% CHEMBL297884
NS3_HCV3A Genome polyprotein -8.78 -8.83 -9.12 N/A N/A
NS5B_HCV1A Genome polyprotein -11.22 -11.31 -10.32 48.76% CHEMBL3644934
NS5B_HCV1B Genome polyprotein -10.71 -9.09 -8.62 39.44% CHEMBL3645199
NS5B_HCV2A Genome polyprotein -9.32 -5.12 N/A N/A N/A
NSP15_SARS Replicase polyprotein 1ab -7.86 N/A N/A 26.37% CHEMBL2441741
NSP1_INFB Non-structural protein 1 -8.23 -8.87 N/A N/A N/A
NSP1_SARS Replicase polyprotein 1ab -6.49 N/A N/A 26.37% CHEMBL2441741
NSP3_HCoV-229E Replicase polyprotein 1a -10.48 N/A N/A N/A N/A
NSP3_IBV Replicase polyprotein 1a -8.35 N/A N/A N/A N/A
NSP3_MHV Replicase polyprotein 1ab -6.98 N/A N/A N/A N/A
NSP9_HCoV-229E Replicase polyprotein 1ab -7.93 -8.08 N/A N/A N/A
PA_A-H17N10 Polymerase acidic protein -10.35 N/A N/A N/A N/A
PA_A-H1N1 Polymerase acidic protein -9.89 -10.98 -10.54 N/A N/A
PA_A-H5N1 Polymerase acidic protein -11.43 -9.82 -10.72 N/A N/A
PA_INFA Polymerase acidic protein -9.10 -10.13 -10.77 28.62% CHEMBL2040640
PA_INFB Polymerase acidic protein -10.69 N/A N/A N/A N/A
PB2_A-H3N2 Polymerase basic protein 2 -9.63 -8.95 N/A N/A N/A
PB2_A-H5N1 Polymerase basic protein 2 -8.57 -9.30 -10.03 N/A N/A
PB2_INFB Polymerase basic protein 2 -10.12 N/A N/A N/A N/A
PB3_A-H3N2 Polymerase basic protein 2 -9.39 N/A N/A N/A N/A
PB4_A-H3N2 Polymerase basic protein 2 -9.38 N/A N/A N/A N/A
PLP_SARS Replicase polyprotein 1a -10.91 -8.75 -8.89 31.83% CHEMBL212080
PR_FCoV Replicase polyprotein 1ab -8.67 N/A N/A N/A N/A
PR_HCoV-229E Replicase polyprotein 1a -8.69 -8.86 N/A N/A N/A
PR_HCoV-NL63 Replicase polyprotein 1a -6.04 -10.07 N/A N/A N/A
PR_HIV1 Gag-Pol polyprotein -8.27 -8.42 -8.13 28.62% CHEMBL492666
PR_HIV2 Gag-Pol polyprotein -8.94 -8.72 N/A N/A N/A
PR_HKU1 Replicase polyprotein 1a -8.17 N/A N/A N/A N/A
PR_HKU4 Replicase polyprotein 1ab -8.03 -8.63 -8.57 N/A N/A
PR_IBV Replicase polyprotein 1a -8.97 N/A N/A N/A N/A
PR_MERs 3C-like proteinase -7.94 -8.07 N/A N/A N/A
PR_PEDV 3C-like proteinase -9.32 N/A N/A N/A N/A
PR_SARS Replicase polyprotein 1ab -8.33 -8.44 -8.60 26.37% CHEMBL2441741
PR_SARS2 3C-like protease -9.16 N/A N/A N/A N/A
PR_TGEV Replicase polyprotein 1a -8.36 N/A N/A N/A N/A
RT_HIV1 Gag-Pol polyprotein -10.74 -9.25 -10.59 37.04% CHEMBL3977507
SPIKE_HCoV-229E Spike glycoprotein -7.30 N/A N/A N/A N/A
SPIKE_HCoV-NL63 Spike glycoprotein -7.52 N/A N/A N/A N/A
SPIKE_HCoV-OC43 Spike glycoprotein -8.57 N/A N/A N/A N/A
SPIKE_HKU4 Spike glycoprotein -8.17 N/A N/A N/A N/A
SPIKE_IBV Spike glycoprotein -7.91 N/A N/A N/A N/A
SPIKE_MERs Spike glycoprotein -8.59 -9.09 -7.49 N/A N/A
SPIKE_MHV Spike glycoprotein -9.07 N/A N/A N/A N/A
SPIKE_PDCoV Spike protein -8.50 N/A N/A N/A N/A
SPIKE_SARS Spike glycoprotein -8.27 -8.35 N/A N/A N/A
SPIKE_SARS2 Spike glycoprotein -7.28 N/A N/A N/A N/A