3-Drugs-Combinations #97 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Ligand Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match
Model 1 Model 2 Model 3
Saquinavir GP160_HIV1 Envelope glycoprotein gp160 -8.07 -8.88 -8.89 N/A N/A
Bictegravir GP160_HIV1 Envelope glycoprotein gp160 -8.02 -8.18 -7.38 N/A N/A
Telaprevir GP160_HIV1 Envelope glycoprotein gp160 -6.94 -6.58 -7.08 N/A N/A
Saquinavir GP160_HIV2 Envelope glycoprotein gp160 -7.19 N/A N/A N/A N/A
Bictegravir GP160_HIV2 Envelope glycoprotein gp160 -8.60 N/A N/A N/A N/A
Telaprevir GP160_HIV2 Envelope glycoprotein gp160 -7.40 N/A N/A N/A N/A
Saquinavir GP_EBOV Envelope glycoprotein -8.64 -8.49 -8.55 45.82% CHEMBL3125895
Bictegravir GP_EBOV Envelope glycoprotein -9.34 -9.70 -8.73 31.95% CHEMBL3125895
Telaprevir GP_EBOV Envelope glycoprotein -8.12 -8.13 -7.91 31.23% CHEMBL3125895
Saquinavir HA_A-H10N7 Hemagglutinin -7.37 N/A N/A N/A N/A
Bictegravir HA_A-H10N7 Hemagglutinin -8.76 N/A N/A N/A N/A
Telaprevir HA_A-H10N7 Hemagglutinin -7.75 N/A N/A N/A N/A
Saquinavir HA_A-H10N8 Hemagglutinin -7.07 N/A N/A N/A N/A
Bictegravir HA_A-H10N8 Hemagglutinin -7.43 N/A N/A N/A N/A
Telaprevir HA_A-H10N8 Hemagglutinin -6.90 N/A N/A N/A N/A
Saquinavir HA_A-H13N6 Hemagglutinin -6.07 N/A N/A N/A N/A
Bictegravir HA_A-H13N6 Hemagglutinin -5.11 N/A N/A N/A N/A
Telaprevir HA_A-H13N6 Hemagglutinin -6.80 N/A N/A N/A N/A
Saquinavir HA_A-H14N6 Hemagglutinin -8.34 N/A N/A N/A N/A
Bictegravir HA_A-H14N6 Hemagglutinin -8.81 N/A N/A N/A N/A
Telaprevir HA_A-H14N6 Hemagglutinin -6.96 N/A N/A N/A N/A
Saquinavir HA_A-H15N9 Hemagglutinin -7.39 N/A N/A N/A N/A
Bictegravir HA_A-H15N9 Hemagglutinin -8.31 N/A N/A N/A N/A
Telaprevir HA_A-H15N9 Hemagglutinin -6.64 N/A N/A N/A N/A
Saquinavir HA_A-H17N10 Hemagglutinin -6.18 N/A N/A N/A N/A
Bictegravir HA_A-H17N10 Hemagglutinin -7.19 N/A N/A N/A N/A
Telaprevir HA_A-H17N10 Hemagglutinin -7.11 N/A N/A N/A N/A
Saquinavir HA_A-H18N11 Hemagglutinin -7.45 N/A N/A N/A N/A
Bictegravir HA_A-H18N11 Hemagglutinin -6.53 N/A N/A N/A N/A
Telaprevir HA_A-H18N11 Hemagglutinin -5.86 N/A N/A N/A N/A
Saquinavir HA_A-H1N1 Hemagglutinin -7.39 -7.48 N/A N/A N/A
Bictegravir HA_A-H1N1 Hemagglutinin -7.81 -7.91 N/A N/A N/A
Telaprevir HA_A-H1N1 Hemagglutinin -7.75 -6.93 N/A N/A N/A
Saquinavir HA_A-H2N2 Hemagglutinin -7.18 -6.90 N/A N/A N/A
Bictegravir HA_A-H2N2 Hemagglutinin -7.84 -7.01 N/A N/A N/A
Telaprevir HA_A-H2N2 Hemagglutinin -6.14 -6.75 N/A N/A N/A
Saquinavir HA_A-H3N2 Hemagglutinin -6.76 -7.30 -6.56 N/A N/A
Bictegravir HA_A-H3N2 Hemagglutinin -8.23 -8.29 -7.91 N/A N/A
Telaprevir HA_A-H3N2 Hemagglutinin -6.19 -6.48 -6.70 N/A N/A
Saquinavir HA_A-H3N8 Hemagglutinin -6.55 -6.33 -6.47 N/A N/A
Bictegravir HA_A-H3N8 Hemagglutinin -7.32 -7.63 -7.35 N/A N/A
Telaprevir HA_A-H3N8 Hemagglutinin -6.56 -7.39 -6.83 N/A N/A
Saquinavir HA_A-H5N1 Hemagglutinin -6.62 -7.29 -7.12 N/A N/A
Bictegravir HA_A-H5N1 Hemagglutinin -8.51 -8.10 -8.04 N/A N/A
Telaprevir HA_A-H5N1 Hemagglutinin -6.41 -7.03 -7.20 N/A N/A
Saquinavir HA_A-H5N3 Hemagglutinin -7.56 -7.17 N/A N/A N/A
Bictegravir HA_A-H5N3 Hemagglutinin -7.27 -8.05 N/A N/A N/A
Telaprevir HA_A-H5N3 Hemagglutinin -6.57 -6.24 N/A N/A N/A
Saquinavir HA_A-H6N1 Hemagglutinin -7.07 N/A N/A N/A N/A
Bictegravir HA_A-H6N1 Hemagglutinin -7.43 N/A N/A N/A N/A
Telaprevir HA_A-H6N1 Hemagglutinin -6.90 N/A N/A N/A N/A
Saquinavir HA_A-H6N6 Hemagglutinin -7.69 N/A N/A N/A N/A
Bictegravir HA_A-H6N6 Hemagglutinin -7.89 N/A N/A N/A N/A
Telaprevir HA_A-H6N6 Hemagglutinin -7.36 N/A N/A N/A N/A
Saquinavir HA_A-H7N2 Hemagglutinin -5.57 -6.40 -7.21 N/A N/A
Bictegravir HA_A-H7N2 Hemagglutinin -7.41 -7.32 -7.29 N/A N/A
Telaprevir HA_A-H7N2 Hemagglutinin -6.78 -6.31 -6.68 N/A N/A
Saquinavir HA_A-H7N7 Hemagglutinin -7.21 -8.03 N/A N/A N/A
Bictegravir HA_A-H7N7 Hemagglutinin -7.31 -8.91 N/A N/A N/A
Telaprevir HA_A-H7N7 Hemagglutinin -5.85 -6.84 N/A N/A N/A
Saquinavir HA_A-H7N9 Hemagglutinin -7.24 N/A N/A N/A N/A
Bictegravir HA_A-H7N9 Hemagglutinin -7.74 N/A N/A N/A N/A
Telaprevir HA_A-H7N9 Hemagglutinin -6.63 N/A N/A N/A N/A
Saquinavir HA_INFB Hemagglutinin -7.43 -6.45 N/A N/A N/A
Bictegravir HA_INFB Hemagglutinin -7.97 -8.24 N/A N/A N/A
Telaprevir HA_INFB Hemagglutinin -7.00 -7.30 N/A N/A N/A
Saquinavir HA_INFD Hemagglutinin-esterase-fusion glycoprotein 44.42 N/A N/A N/A N/A
Bictegravir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -5.24 N/A N/A N/A N/A
Telaprevir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.43 N/A N/A N/A N/A
Saquinavir HE_BCV Hemagglutinin-esterase -7.07 -7.09 N/A N/A N/A
Bictegravir HE_BCV Hemagglutinin-esterase -8.44 -7.89 N/A N/A N/A
Telaprevir HE_BCV Hemagglutinin-esterase -8.32 -7.22 N/A N/A N/A
Saquinavir HE_HCoV-OC43 Hemagglutinin-esterase -6.50 N/A N/A N/A N/A
Bictegravir HE_HCoV-OC43 Hemagglutinin-esterase -7.02 N/A N/A N/A N/A
Telaprevir HE_HCoV-OC43 Hemagglutinin-esterase -5.75 N/A N/A N/A N/A
Saquinavir HE_MHV Hemagglutinin-esterase -6.84 N/A N/A N/A N/A
Bictegravir HE_MHV Hemagglutinin-esterase -7.29 N/A N/A N/A N/A
Telaprevir HE_MHV Hemagglutinin-esterase -6.15 N/A N/A N/A N/A
Saquinavir IN_HIV1 Gag-Pol polyprotein -6.09 -7.42 N/A N/A N/A
Bictegravir IN_HIV1 Gag-Pol polyprotein -6.27 -6.94 N/A N/A N/A
Telaprevir IN_HIV1 Gag-Pol polyprotein -5.47 -5.38 N/A N/A N/A
Saquinavir MD_HKU4 Replicase polyprotein 1ab -10.20 -9.04 -9.75 N/A N/A
Bictegravir MD_HKU4 Replicase polyprotein 1ab -10.19 -10.05 -10.22 N/A N/A
Telaprevir MD_HKU4 Replicase polyprotein 1ab -7.52 -7.37 -7.40 N/A N/A
Saquinavir MD_MERs Replicase polyprotein 1a -10.42 -10.00 N/A N/A N/A
Bictegravir MD_MERs Replicase polyprotein 1a -10.38 -10.08 N/A N/A N/A
Telaprevir MD_MERs Replicase polyprotein 1a -8.15 -9.35 N/A N/A N/A
Saquinavir MX2_A-H5N1 Matrix protein 2 10.59 N/A N/A N/A N/A
Bictegravir MX2_A-H5N1 Matrix protein 2 -9.98 N/A N/A N/A N/A
Telaprevir MX2_A-H5N1 Matrix protein 2 16.02 N/A N/A N/A N/A
Saquinavir NA_A-H11N6 Neuraminidase -8.75 -8.91 -8.67 N/A N/A
Bictegravir NA_A-H11N6 Neuraminidase -9.92 -9.55 -9.60 N/A N/A
Telaprevir NA_A-H11N6 Neuraminidase -7.59 -7.55 -7.18 N/A N/A
Saquinavir NA_A-H11N9 Neuraminidase -8.78 -10.03 -10.61 N/A N/A
Bictegravir NA_A-H11N9 Neuraminidase -8.21 -9.74 -9.42 N/A N/A
Telaprevir NA_A-H11N9 Neuraminidase -6.28 -7.61 -9.37 N/A N/A
Saquinavir NA_A-H12N5 Neuraminidase -9.87 -9.83 -8.58 N/A N/A
Bictegravir NA_A-H12N5 Neuraminidase -9.67 -9.61 -9.66 N/A N/A
Telaprevir NA_A-H12N5 Neuraminidase -7.01 -7.88 -7.80 N/A N/A
Saquinavir NA_A-H13N9 Neuraminidase -7.35 N/A N/A N/A N/A
Bictegravir NA_A-H13N9 Neuraminidase -8.35 N/A N/A N/A N/A
Telaprevir NA_A-H13N9 Neuraminidase -6.65 N/A N/A N/A N/A
Saquinavir NA_A-H17N10 Neuraminidase -7.98 N/A N/A N/A N/A
Bictegravir NA_A-H17N10 Neuraminidase -9.24 N/A N/A N/A N/A
Telaprevir NA_A-H17N10 Neuraminidase -7.43 N/A N/A N/A N/A
Saquinavir NA_A-H18N11 Neuraminidase -7.43 N/A N/A N/A N/A
Bictegravir NA_A-H18N11 Neuraminidase -8.37 N/A N/A N/A N/A
Telaprevir NA_A-H18N11 Neuraminidase -7.80 N/A N/A N/A N/A
Saquinavir NA_A-H1N1 Neuraminidase -9.88 N/A N/A N/A N/A
Bictegravir NA_A-H1N1 Neuraminidase -9.58 N/A N/A N/A N/A
Telaprevir NA_A-H1N1 Neuraminidase -8.27 N/A N/A N/A N/A
Saquinavir NA_A-H2N2 Neuraminidase -8.47 -9.46 -8.92 N/A N/A
Bictegravir NA_A-H2N2 Neuraminidase -8.68 -10.03 -9.34 N/A N/A
Telaprevir NA_A-H2N2 Neuraminidase -8.58 -8.55 -8.46 N/A N/A
Saquinavir NA_A-H3N2 Ig heavy chain Mem5 -9.17 -7.72 N/A N/A N/A
Bictegravir NA_A-H3N2 Ig heavy chain Mem5 -9.29 -9.28 N/A N/A N/A
Telaprevir NA_A-H3N2 Ig heavy chain Mem5 -8.69 -7.35 N/A N/A N/A
Saquinavir NA_A-H3N8 Neuraminidase -9.09 -9.27 -9.80 N/A N/A
Bictegravir NA_A-H3N8 Neuraminidase -9.62 -9.33 -10.04 N/A N/A
Telaprevir NA_A-H3N8 Neuraminidase -9.08 -8.94 -9.08 N/A N/A
Saquinavir NA_A-H5N1 Neuraminidase -9.90 N/A N/A N/A N/A
Bictegravir NA_A-H5N1 Neuraminidase -9.17 N/A N/A N/A N/A
Telaprevir NA_A-H5N1 Neuraminidase -8.53 N/A N/A N/A N/A
Saquinavir NA_A-H7N9 Neuraminidase -10.11 -10.00 -9.78 N/A N/A
Bictegravir NA_A-H7N9 Neuraminidase -9.64 -9.85 -9.61 N/A N/A
Telaprevir NA_A-H7N9 Neuraminidase -9.28 -8.99 -8.50 N/A N/A
Saquinavir NA_INFB Neuraminidase -8.57 -8.64 N/A 38.74% CHEMBL362993
Bictegravir NA_INFB Neuraminidase -8.98 -8.55 N/A 31.12% CHEMBL4175983
Telaprevir NA_INFB Neuraminidase -7.78 -7.36 N/A 42.76% CHEMBL195288
Saquinavir NP_A-H1N1 Nucleoprotein -7.08 -8.06 -7.36 N/A N/A
Bictegravir NP_A-H1N1 Nucleoprotein -7.87 -8.34 -8.75 N/A N/A
Telaprevir NP_A-H1N1 Nucleoprotein -6.59 -6.41 -6.86 N/A N/A
Saquinavir NP_A-H5N1 Nucleoprotein -7.51 N/A N/A N/A N/A
Bictegravir NP_A-H5N1 Nucleoprotein -8.06 N/A N/A N/A N/A
Telaprevir NP_A-H5N1 Nucleoprotein -6.88 N/A N/A N/A N/A
Saquinavir NP_HCoV-NL63 Nucleoprotein -7.54 N/A N/A N/A N/A
Bictegravir NP_HCoV-NL63 Nucleoprotein -9.22 N/A N/A N/A N/A
Telaprevir NP_HCoV-NL63 Nucleoprotein -7.35 N/A N/A N/A N/A
Saquinavir NP_HCoV-OC43 Nucleoprotein -9.41 -7.91 -8.06 27.27% CHEMBL3233481
Bictegravir NP_HCoV-OC43 Nucleoprotein -11.95 -8.90 -8.08 15.54% CHEMBL3233481
Telaprevir NP_HCoV-OC43 Nucleoprotein -8.01 -6.74 -7.42 17.33% CHEMBL3233481
Saquinavir NP_INFB Nucleoprotein -6.72 N/A N/A N/A N/A
Bictegravir NP_INFB Nucleoprotein -6.19 N/A N/A N/A N/A
Telaprevir NP_INFB Nucleoprotein -5.94 N/A N/A N/A N/A
Saquinavir NP_INFD NP -6.54 N/A N/A N/A N/A
Bictegravir NP_INFD NP -6.76 N/A N/A N/A N/A
Telaprevir NP_INFD NP -5.27 N/A N/A N/A N/A
Saquinavir NP_SARS Nucleoprotein -8.15 N/A N/A N/A N/A
Bictegravir NP_SARS Nucleoprotein -9.04 N/A N/A N/A N/A
Telaprevir NP_SARS Nucleoprotein -7.54 N/A N/A N/A N/A
Saquinavir NS3_HCV1A Genome polyprotein -8.26 -6.77 -7.22 54.12% CHEMBL3645761
Bictegravir NS3_HCV1A Genome polyprotein -7.77 -7.76 -9.84 37.41% CHEMBL3645743
Telaprevir NS3_HCV1A Genome polyprotein -6.90 -6.30 -7.67 67.11% CHEMBL3645733
Saquinavir NS3_HCV1B Genome polyprotein -9.29 -9.13 -6.79 50.00% CHEMBL3954962
Bictegravir NS3_HCV1B Genome polyprotein -10.06 -10.79 -7.31 35.82% CHEMBL3954962
Telaprevir NS3_HCV1B Genome polyprotein -7.27 -7.98 -6.54 100.00% CHEMBL231813
Saquinavir NS3_HCV3A Genome polyprotein -7.20 -6.55 -6.88 N/A N/A
Bictegravir NS3_HCV3A Genome polyprotein -9.34 -9.04 -7.87 N/A N/A
Telaprevir NS3_HCV3A Genome polyprotein -8.12 -7.60 -7.42 N/A N/A
Saquinavir NS5B_HCV1A Genome polyprotein -9.35 -10.52 -9.48 53.22% CHEMBL13256
Bictegravir NS5B_HCV1A Genome polyprotein -10.61 -9.96 -10.18 36.11% CHEMBL3644880
Telaprevir NS5B_HCV1A Genome polyprotein -8.94 -8.92 -8.81 88.43% CHEMBL13256
Saquinavir NS5B_HCV1B Genome polyprotein -9.45 -9.30 -8.99 40.47% CHEMBL3645202
Bictegravir NS5B_HCV1B Genome polyprotein -9.58 -9.62 -8.92 36.31% CHEMBL3645214
Telaprevir NS5B_HCV1B Genome polyprotein -9.60 -7.70 -8.33 29.25% CHEMBL3645202
Saquinavir NS5B_HCV2A Genome polyprotein -11.35 -9.51 N/A N/A N/A
Bictegravir NS5B_HCV2A Genome polyprotein -11.00 -10.69 N/A N/A N/A
Telaprevir NS5B_HCV2A Genome polyprotein -8.15 -5.42 N/A N/A N/A
Saquinavir NSP15_SARS Replicase polyprotein 1ab -3.59 N/A N/A 47.25% CHEMBL2441745
Bictegravir NSP15_SARS Replicase polyprotein 1ab -8.04 N/A N/A 24.29% CHEMBL2441745
Telaprevir NSP15_SARS Replicase polyprotein 1ab -0.92 N/A N/A 39.29% CHEMBL2441745
Saquinavir NSP1_INFB Non-structural protein 1 -6.21 -6.97 N/A N/A N/A
Bictegravir NSP1_INFB Non-structural protein 1 -7.15 -7.45 N/A N/A N/A
Telaprevir NSP1_INFB Non-structural protein 1 -6.96 -6.86 N/A N/A N/A
Saquinavir NSP1_SARS Replicase polyprotein 1ab -7.29 N/A N/A 47.25% CHEMBL2441745
Bictegravir NSP1_SARS Replicase polyprotein 1ab -7.95 N/A N/A 24.29% CHEMBL2441745
Telaprevir NSP1_SARS Replicase polyprotein 1ab -5.62 N/A N/A 39.29% CHEMBL2441745
Saquinavir NSP3_HCoV-229E Replicase polyprotein 1a -10.99 N/A N/A N/A N/A
Bictegravir NSP3_HCoV-229E Replicase polyprotein 1a -11.83 N/A N/A N/A N/A
Telaprevir NSP3_HCoV-229E Replicase polyprotein 1a -8.66 N/A N/A N/A N/A
Saquinavir NSP3_IBV Replicase polyprotein 1a -9.25 N/A N/A N/A N/A
Bictegravir NSP3_IBV Replicase polyprotein 1a -10.98 N/A N/A N/A N/A
Telaprevir NSP3_IBV Replicase polyprotein 1a -8.31 N/A N/A N/A N/A
Saquinavir NSP3_MHV Replicase polyprotein 1ab 33.98 N/A N/A N/A N/A
Bictegravir NSP3_MHV Replicase polyprotein 1ab -5.99 N/A N/A N/A N/A
Telaprevir NSP3_MHV Replicase polyprotein 1ab -7.58 N/A N/A N/A N/A
Saquinavir NSP9_HCoV-229E Replicase polyprotein 1ab -7.05 -6.83 N/A N/A N/A
Bictegravir NSP9_HCoV-229E Replicase polyprotein 1ab -7.93 -8.26 N/A N/A N/A
Telaprevir NSP9_HCoV-229E Replicase polyprotein 1ab -6.55 -6.77 N/A N/A N/A
Saquinavir PA_A-H17N10 Polymerase acidic protein -7.90 N/A N/A N/A N/A
Bictegravir PA_A-H17N10 Polymerase acidic protein -9.52 N/A N/A N/A N/A
Telaprevir PA_A-H17N10 Polymerase acidic protein -8.18 N/A N/A N/A N/A
Saquinavir PA_A-H1N1 Polymerase acidic protein -10.93 -9.72 -9.35 N/A N/A
Bictegravir PA_A-H1N1 Polymerase acidic protein -10.75 -9.31 -10.06 N/A N/A
Telaprevir PA_A-H1N1 Polymerase acidic protein -8.36 -9.11 -8.43 N/A N/A
Saquinavir PA_A-H5N1 Polymerase acidic protein -9.73 -9.86 -9.93 N/A N/A
Bictegravir PA_A-H5N1 Polymerase acidic protein -10.31 -10.27 -10.01 N/A N/A
Telaprevir PA_A-H5N1 Polymerase acidic protein -9.83 -9.02 -9.44 N/A N/A
Saquinavir PA_INFA Polymerase acidic protein -9.22 -8.55 -9.56 35.43% CHEMBL463590
Bictegravir PA_INFA Polymerase acidic protein -11.03 -9.40 -9.72 30.00% CHEMBL2040578
Telaprevir PA_INFA Polymerase acidic protein -7.87 -7.62 -8.59 31.63% CHEMBL2040569
Saquinavir PA_INFB Polymerase acidic protein -9.27 N/A N/A N/A N/A
Bictegravir PA_INFB Polymerase acidic protein -9.27 N/A N/A N/A N/A
Telaprevir PA_INFB Polymerase acidic protein -7.63 N/A N/A N/A N/A
Saquinavir PB2_A-H3N2 Polymerase basic protein 2 -9.77 -8.06 N/A N/A N/A
Bictegravir PB2_A-H3N2 Polymerase basic protein 2 -9.42 -10.01 N/A N/A N/A
Telaprevir PB2_A-H3N2 Polymerase basic protein 2 -7.83 -7.75 N/A N/A N/A
Saquinavir PB2_A-H5N1 Polymerase basic protein 2 -8.29 -7.95 -8.58 N/A N/A
Bictegravir PB2_A-H5N1 Polymerase basic protein 2 -7.99 -9.45 -9.20 N/A N/A
Telaprevir PB2_A-H5N1 Polymerase basic protein 2 -6.57 -7.78 -7.13 N/A N/A
Saquinavir PB2_INFB Polymerase basic protein 2 -8.43 N/A N/A N/A N/A
Bictegravir PB2_INFB Polymerase basic protein 2 -9.64 N/A N/A N/A N/A
Telaprevir PB2_INFB Polymerase basic protein 2 -7.80 N/A N/A N/A N/A
Saquinavir PB3_A-H3N2 Polymerase basic protein 2 -8.17 N/A N/A N/A N/A
Bictegravir PB3_A-H3N2 Polymerase basic protein 2 -8.72 N/A N/A N/A N/A
Telaprevir PB3_A-H3N2 Polymerase basic protein 2 -6.95 N/A N/A N/A N/A
Saquinavir PB4_A-H3N2 Polymerase basic protein 2 -9.38 N/A N/A N/A N/A
Bictegravir PB4_A-H3N2 Polymerase basic protein 2 -9.98 N/A N/A N/A N/A
Telaprevir PB4_A-H3N2 Polymerase basic protein 2 -8.10 N/A N/A N/A N/A
Saquinavir PLP_SARS Replicase polyprotein 1a -9.13 -11.03 -11.05 36.79% CHEMBL213054
Bictegravir PLP_SARS Replicase polyprotein 1a -10.77 -10.34 -10.68 29.32% CHEMBL213054
Telaprevir PLP_SARS Replicase polyprotein 1a -8.89 -8.92 -8.71 34.50% CHEMBL213054
Saquinavir PR_FCoV Replicase polyprotein 1ab -8.42 N/A N/A N/A N/A
Bictegravir PR_FCoV Replicase polyprotein 1ab -9.64 N/A N/A N/A N/A
Telaprevir PR_FCoV Replicase polyprotein 1ab -8.03 N/A N/A N/A N/A
Saquinavir PR_HCoV-229E Replicase polyprotein 1a -8.25 -8.09 N/A N/A N/A
Bictegravir PR_HCoV-229E Replicase polyprotein 1a -9.47 -8.63 N/A N/A N/A
Telaprevir PR_HCoV-229E Replicase polyprotein 1a -7.42 -7.75 N/A N/A N/A
Saquinavir PR_HCoV-NL63 Replicase polyprotein 1a -5.49 -8.90 N/A N/A N/A
Bictegravir PR_HCoV-NL63 Replicase polyprotein 1a -5.32 -9.41 N/A N/A N/A
Telaprevir PR_HCoV-NL63 Replicase polyprotein 1a -5.51 -8.44 N/A N/A N/A
Saquinavir PR_HIV1 Gag-Pol polyprotein -7.62 -7.95 -7.93 31.65% CHEMBL492666
Bictegravir PR_HIV1 Gag-Pol polyprotein -8.39 -8.43 -7.97 25.83% CHEMBL3645128
Telaprevir PR_HIV1 Gag-Pol polyprotein -7.12 -7.03 -7.24 20.48% CHEMBL492666
Saquinavir PR_HIV2 Gag-Pol polyprotein -7.61 -8.12 N/A N/A N/A
Bictegravir PR_HIV2 Gag-Pol polyprotein -8.90 -8.45 N/A N/A N/A
Telaprevir PR_HIV2 Gag-Pol polyprotein -7.57 -7.31 N/A N/A N/A
Saquinavir PR_HKU1 Replicase polyprotein 1a -8.80 N/A N/A N/A N/A
Bictegravir PR_HKU1 Replicase polyprotein 1a -8.52 N/A N/A N/A N/A
Telaprevir PR_HKU1 Replicase polyprotein 1a -6.96 N/A N/A N/A N/A
Saquinavir PR_HKU4 Replicase polyprotein 1ab -8.57 -9.37 -8.03 N/A N/A
Bictegravir PR_HKU4 Replicase polyprotein 1ab -8.88 -8.73 -8.59 N/A N/A
Telaprevir PR_HKU4 Replicase polyprotein 1ab -6.52 -7.04 -7.12 N/A N/A
Saquinavir PR_IBV Replicase polyprotein 1a -9.03 N/A N/A N/A N/A
Bictegravir PR_IBV Replicase polyprotein 1a -9.50 N/A N/A N/A N/A
Telaprevir PR_IBV Replicase polyprotein 1a -7.85 N/A N/A N/A N/A
Saquinavir PR_MERs 3C-like proteinase -9.43 -9.12 N/A N/A N/A
Bictegravir PR_MERs 3C-like proteinase -8.92 -9.59 N/A N/A N/A
Telaprevir PR_MERs 3C-like proteinase -7.77 -8.16 N/A N/A N/A
Saquinavir PR_PEDV 3C-like proteinase -8.36 N/A N/A N/A N/A
Bictegravir PR_PEDV 3C-like proteinase -9.08 N/A N/A N/A N/A
Telaprevir PR_PEDV 3C-like proteinase -7.54 N/A N/A N/A N/A
Saquinavir PR_SARS Replicase polyprotein 1ab -8.83 -9.25 -8.27 47.25% CHEMBL2441745
Bictegravir PR_SARS Replicase polyprotein 1ab -9.79 -8.65 -8.88 24.29% CHEMBL2441745
Telaprevir PR_SARS Replicase polyprotein 1ab -7.02 -6.61 -7.63 39.29% CHEMBL2441745
Saquinavir PR_SARS2 3C-like protease -9.04 N/A N/A N/A N/A
Bictegravir PR_SARS2 3C-like protease -9.47 N/A N/A N/A N/A
Telaprevir PR_SARS2 3C-like protease -7.88 N/A N/A N/A N/A
Saquinavir PR_TGEV Replicase polyprotein 1a -8.18 N/A N/A N/A N/A
Bictegravir PR_TGEV Replicase polyprotein 1a -8.53 N/A N/A N/A N/A
Telaprevir PR_TGEV Replicase polyprotein 1a -7.06 N/A N/A N/A N/A
Saquinavir RT_HIV1 Gag-Pol polyprotein -9.93 -10.18 -9.54 41.94% CHEMBL4227326
Bictegravir RT_HIV1 Gag-Pol polyprotein -11.02 -11.90 -10.85 30.95% CHEMBL4109767
Telaprevir RT_HIV1 Gag-Pol polyprotein -9.22 -9.13 -8.55 31.17% CHEMBL3921297
Saquinavir SPIKE_HCoV-229E Spike glycoprotein -5.15 N/A N/A N/A N/A
Bictegravir SPIKE_HCoV-229E Spike glycoprotein -6.23 N/A N/A N/A N/A
Telaprevir SPIKE_HCoV-229E Spike glycoprotein -5.11 N/A N/A N/A N/A
Saquinavir SPIKE_HCoV-NL63 Spike glycoprotein -6.53 N/A N/A N/A N/A
Bictegravir SPIKE_HCoV-NL63 Spike glycoprotein -7.50 N/A N/A N/A N/A
Telaprevir SPIKE_HCoV-NL63 Spike glycoprotein -5.48 N/A N/A N/A N/A
Saquinavir SPIKE_HCoV-OC43 Spike glycoprotein -7.41 N/A N/A N/A N/A
Bictegravir SPIKE_HCoV-OC43 Spike glycoprotein -7.77 N/A N/A N/A N/A
Telaprevir SPIKE_HCoV-OC43 Spike glycoprotein -7.04 N/A N/A N/A N/A
Saquinavir SPIKE_HKU4 Spike glycoprotein -7.23 N/A N/A N/A N/A
Bictegravir SPIKE_HKU4 Spike glycoprotein -8.33 N/A N/A N/A N/A
Telaprevir SPIKE_HKU4 Spike glycoprotein -6.87 N/A N/A N/A N/A
Saquinavir SPIKE_IBV Spike glycoprotein -6.26 N/A N/A N/A N/A
Bictegravir SPIKE_IBV Spike glycoprotein -7.76 N/A N/A N/A N/A
Telaprevir SPIKE_IBV Spike glycoprotein -6.54 N/A N/A N/A N/A
Saquinavir SPIKE_MERs Spike glycoprotein -7.70 -7.10 -6.48 N/A N/A
Bictegravir SPIKE_MERs Spike glycoprotein -8.52 -7.63 -7.41 N/A N/A
Telaprevir SPIKE_MERs Spike glycoprotein -6.19 -6.03 -5.81 N/A N/A
Saquinavir SPIKE_MHV Spike glycoprotein -6.74 N/A N/A N/A N/A
Bictegravir SPIKE_MHV Spike glycoprotein -8.99 N/A N/A N/A N/A
Telaprevir SPIKE_MHV Spike glycoprotein -7.70 N/A N/A N/A N/A
Saquinavir SPIKE_PDCoV Spike protein -6.48 N/A N/A N/A N/A
Bictegravir SPIKE_PDCoV Spike protein -8.15 N/A N/A N/A N/A
Telaprevir SPIKE_PDCoV Spike protein -7.47 N/A N/A N/A N/A
Saquinavir SPIKE_SARS Spike glycoprotein -6.33 -6.25 N/A N/A N/A
Bictegravir SPIKE_SARS Spike glycoprotein -7.85 -7.69 N/A N/A N/A
Telaprevir SPIKE_SARS Spike glycoprotein -6.35 -5.92 N/A N/A N/A
Saquinavir SPIKE_SARS2 Spike glycoprotein -5.73 N/A N/A N/A N/A
Bictegravir SPIKE_SARS2 Spike glycoprotein -7.23 N/A N/A N/A N/A
Telaprevir SPIKE_SARS2 Spike glycoprotein -6.01 N/A N/A N/A N/A