LTJv1 #77 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
Fosinopril GP160_HIV1 Envelope glycoprotein gp160 -7.04 -7.23 -7.29 N/A N/A
abacavir GP160_HIV1 Envelope glycoprotein gp160 -6.59 -5.83 -5.86 N/A N/A
Atazanavir GP160_HIV1 Envelope glycoprotein gp160 -7.58 -7.77 -7.46 N/A N/A
Peramivir GP160_HIV1 Envelope glycoprotein gp160 -5.71 -6.03 -6.02 N/A N/A
Fosinopril GP160_HIV2 Envelope glycoprotein gp160 -5.84 N/A N/A N/A N/A
abacavir GP160_HIV2 Envelope glycoprotein gp160 -6.05 N/A N/A N/A N/A
Atazanavir GP160_HIV2 Envelope glycoprotein gp160 -6.69 N/A N/A N/A N/A
Peramivir GP160_HIV2 Envelope glycoprotein gp160 -5.99 N/A N/A N/A N/A
Fosinopril GP_EBOV Envelope glycoprotein -6.77 -7.55 -7.52 27.78% CHEMBL3125899
abacavir GP_EBOV Envelope glycoprotein -6.81 -6.85 -6.38 21.09% CHEMBL3125899
Atazanavir GP_EBOV Envelope glycoprotein -7.76 -8.38 -7.56 35.56% CHEMBL3125895
Peramivir GP_EBOV Envelope glycoprotein -6.15 -5.69 -5.86 27.75% CHEMBL3125895
Fosinopril HA_A-H10N7 Hemagglutinin -5.95 N/A N/A N/A N/A
abacavir HA_A-H10N7 Hemagglutinin -6.19 N/A N/A N/A N/A
Atazanavir HA_A-H10N7 Hemagglutinin -6.72 N/A N/A N/A N/A
Peramivir HA_A-H10N7 Hemagglutinin -6.15 N/A N/A N/A N/A
Fosinopril HA_A-H10N8 Hemagglutinin -6.50 N/A N/A N/A N/A
abacavir HA_A-H10N8 Hemagglutinin -5.95 N/A N/A N/A N/A
Atazanavir HA_A-H10N8 Hemagglutinin -6.64 N/A N/A N/A N/A
Peramivir HA_A-H10N8 Hemagglutinin -5.85 N/A N/A N/A N/A
Fosinopril HA_A-H13N6 Hemagglutinin 6.08 N/A N/A N/A N/A
abacavir HA_A-H13N6 Hemagglutinin -5.52 N/A N/A N/A N/A
Atazanavir HA_A-H13N6 Hemagglutinin -6.63 N/A N/A N/A N/A
Peramivir HA_A-H13N6 Hemagglutinin -5.22 N/A N/A N/A N/A
Fosinopril HA_A-H14N6 Hemagglutinin -6.74 N/A N/A N/A N/A
abacavir HA_A-H14N6 Hemagglutinin -6.40 N/A N/A N/A N/A
Atazanavir HA_A-H14N6 Hemagglutinin -6.96 N/A N/A N/A N/A
Peramivir HA_A-H14N6 Hemagglutinin -5.50 N/A N/A N/A N/A
Fosinopril HA_A-H15N9 Hemagglutinin -6.17 N/A N/A N/A N/A
abacavir HA_A-H15N9 Hemagglutinin -6.56 N/A N/A N/A N/A
Atazanavir HA_A-H15N9 Hemagglutinin -6.02 N/A N/A N/A N/A
Peramivir HA_A-H15N9 Hemagglutinin -5.86 N/A N/A N/A N/A
Fosinopril HA_A-H17N10 Hemagglutinin -4.40 N/A N/A N/A N/A
abacavir HA_A-H17N10 Hemagglutinin -5.99 N/A N/A N/A N/A
Atazanavir HA_A-H17N10 Hemagglutinin -6.30 N/A N/A N/A N/A
Peramivir HA_A-H17N10 Hemagglutinin -5.16 N/A N/A N/A N/A
Fosinopril HA_A-H18N11 Hemagglutinin -4.80 N/A N/A N/A N/A
abacavir HA_A-H18N11 Hemagglutinin -5.43 N/A N/A N/A N/A
Atazanavir HA_A-H18N11 Hemagglutinin -6.63 N/A N/A N/A N/A
Peramivir HA_A-H18N11 Hemagglutinin -4.97 N/A N/A N/A N/A
Fosinopril HA_A-H1N1 Hemagglutinin -5.90 -6.00 N/A N/A N/A
abacavir HA_A-H1N1 Hemagglutinin -6.15 -5.94 N/A N/A N/A
Atazanavir HA_A-H1N1 Hemagglutinin -6.88 -6.37 N/A N/A N/A
Peramivir HA_A-H1N1 Hemagglutinin -5.79 -5.67 N/A N/A N/A
Fosinopril HA_A-H2N2 Hemagglutinin -5.60 -6.07 N/A N/A N/A
abacavir HA_A-H2N2 Hemagglutinin -6.04 -5.43 N/A N/A N/A
Atazanavir HA_A-H2N2 Hemagglutinin -6.60 -5.81 N/A N/A N/A
Peramivir HA_A-H2N2 Hemagglutinin -5.91 -5.42 N/A N/A N/A
Fosinopril HA_A-H3N2 Hemagglutinin -5.94 -5.95 -6.03 N/A N/A
abacavir HA_A-H3N2 Hemagglutinin -6.37 -6.33 -6.00 N/A N/A
Atazanavir HA_A-H3N2 Hemagglutinin -6.94 -5.82 -6.33 N/A N/A
Peramivir HA_A-H3N2 Hemagglutinin -5.34 -5.18 -5.19 N/A N/A
Fosinopril HA_A-H3N8 Hemagglutinin -6.09 -5.49 -6.06 N/A N/A
abacavir HA_A-H3N8 Hemagglutinin -6.11 -5.69 -5.61 N/A N/A
Atazanavir HA_A-H3N8 Hemagglutinin -5.72 -6.01 -6.73 N/A N/A
Peramivir HA_A-H3N8 Hemagglutinin -5.03 -5.77 -5.83 N/A N/A
Fosinopril HA_A-H5N1 Hemagglutinin -6.06 -6.02 -5.81 N/A N/A
abacavir HA_A-H5N1 Hemagglutinin -7.11 -6.18 -6.50 N/A N/A
Atazanavir HA_A-H5N1 Hemagglutinin -6.23 -6.62 -6.40 N/A N/A
Peramivir HA_A-H5N1 Hemagglutinin -5.94 -5.64 -5.48 N/A N/A
Fosinopril HA_A-H5N3 Hemagglutinin -5.89 -5.78 N/A N/A N/A
abacavir HA_A-H5N3 Hemagglutinin -6.63 -5.71 N/A N/A N/A
Atazanavir HA_A-H5N3 Hemagglutinin -6.63 -6.44 N/A N/A N/A
Peramivir HA_A-H5N3 Hemagglutinin -6.40 -6.31 N/A N/A N/A
Fosinopril HA_A-H6N1 Hemagglutinin -6.50 N/A N/A N/A N/A
abacavir HA_A-H6N1 Hemagglutinin -5.95 N/A N/A N/A N/A
Atazanavir HA_A-H6N1 Hemagglutinin -6.64 N/A N/A N/A N/A
Peramivir HA_A-H6N1 Hemagglutinin -5.85 N/A N/A N/A N/A
Fosinopril HA_A-H6N6 Hemagglutinin -6.45 N/A N/A N/A N/A
abacavir HA_A-H6N6 Hemagglutinin -6.03 N/A N/A N/A N/A
Atazanavir HA_A-H6N6 Hemagglutinin -6.69 N/A N/A N/A N/A
Peramivir HA_A-H6N6 Hemagglutinin -5.50 N/A N/A N/A N/A
Fosinopril HA_A-H7N2 Hemagglutinin -6.12 -5.69 -5.50 N/A N/A
abacavir HA_A-H7N2 Hemagglutinin -6.46 -6.06 -6.16 N/A N/A
Atazanavir HA_A-H7N2 Hemagglutinin -6.13 -5.88 -5.81 N/A N/A
Peramivir HA_A-H7N2 Hemagglutinin -6.01 -5.17 -5.97 N/A N/A
Fosinopril HA_A-H7N7 Hemagglutinin -5.76 -7.49 N/A N/A N/A
abacavir HA_A-H7N7 Hemagglutinin -5.83 -6.16 N/A N/A N/A
Atazanavir HA_A-H7N7 Hemagglutinin -6.02 -6.80 N/A N/A N/A
Peramivir HA_A-H7N7 Hemagglutinin -5.68 -5.34 N/A N/A N/A
Fosinopril HA_A-H7N9 Hemagglutinin -5.83 N/A N/A N/A N/A
abacavir HA_A-H7N9 Hemagglutinin -6.09 N/A N/A N/A N/A
Atazanavir HA_A-H7N9 Hemagglutinin -7.39 N/A N/A N/A N/A
Peramivir HA_A-H7N9 Hemagglutinin -5.63 N/A N/A N/A N/A
Fosinopril HA_INFB Hemagglutinin -5.73 -6.29 N/A N/A N/A
abacavir HA_INFB Hemagglutinin -6.50 -6.28 N/A N/A N/A
Atazanavir HA_INFB Hemagglutinin -6.13 -6.57 N/A N/A N/A
Peramivir HA_INFB Hemagglutinin -5.37 -6.14 N/A N/A N/A
Fosinopril HA_INFD Hemagglutinin-esterase-fusion glycoprotein 2.89 N/A N/A N/A N/A
abacavir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -4.39 N/A N/A N/A N/A
Atazanavir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -5.66 N/A N/A N/A N/A
Peramivir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -5.34 N/A N/A N/A N/A
Fosinopril HE_BCV Hemagglutinin-esterase -6.22 -6.11 N/A N/A N/A
abacavir HE_BCV Hemagglutinin-esterase -6.09 -5.84 N/A N/A N/A
Atazanavir HE_BCV Hemagglutinin-esterase -7.11 -6.85 N/A N/A N/A
Peramivir HE_BCV Hemagglutinin-esterase -6.40 -6.32 N/A N/A N/A
Fosinopril HE_HCoV-OC43 Hemagglutinin-esterase -5.88 N/A N/A N/A N/A
abacavir HE_HCoV-OC43 Hemagglutinin-esterase -5.45 N/A N/A N/A N/A
Atazanavir HE_HCoV-OC43 Hemagglutinin-esterase -5.11 N/A N/A N/A N/A
Peramivir HE_HCoV-OC43 Hemagglutinin-esterase -4.91 N/A N/A N/A N/A
Fosinopril HE_MHV Hemagglutinin-esterase -5.81 N/A N/A N/A N/A
abacavir HE_MHV Hemagglutinin-esterase -5.83 N/A N/A N/A N/A
Atazanavir HE_MHV Hemagglutinin-esterase -6.01 N/A N/A N/A N/A
Peramivir HE_MHV Hemagglutinin-esterase -5.13 N/A N/A N/A N/A
Fosinopril IN_HIV1 Gag-Pol polyprotein -5.14 -6.18 N/A N/A N/A
abacavir IN_HIV1 Gag-Pol polyprotein -5.30 -5.09 N/A N/A N/A
Atazanavir IN_HIV1 Gag-Pol polyprotein -6.12 -5.81 N/A N/A N/A
Peramivir IN_HIV1 Gag-Pol polyprotein -4.59 -4.47 N/A N/A N/A
Fosinopril MD_HKU4 Replicase polyprotein 1ab -8.02 -7.62 -8.06 N/A N/A
abacavir MD_HKU4 Replicase polyprotein 1ab -8.40 -8.28 -8.32 N/A N/A
Atazanavir MD_HKU4 Replicase polyprotein 1ab -7.58 -7.76 -7.68 N/A N/A
Peramivir MD_HKU4 Replicase polyprotein 1ab -6.76 -6.30 -6.47 N/A N/A
Fosinopril MD_MERs Replicase polyprotein 1a -8.35 -8.07 N/A N/A N/A
abacavir MD_MERs Replicase polyprotein 1a -8.72 -8.23 N/A N/A N/A
Atazanavir MD_MERs Replicase polyprotein 1a -7.61 -7.91 N/A N/A N/A
Peramivir MD_MERs Replicase polyprotein 1a -6.91 -6.61 N/A N/A N/A
Fosinopril MX2_A-H5N1 Matrix protein 2 -0.79 N/A N/A N/A N/A
abacavir MX2_A-H5N1 Matrix protein 2 -8.79 N/A N/A N/A N/A
Atazanavir MX2_A-H5N1 Matrix protein 2 12.84 N/A N/A N/A N/A
Peramivir MX2_A-H5N1 Matrix protein 2 -7.92 N/A N/A N/A N/A
Fosinopril NA_A-H11N6 Neuraminidase -8.17 -7.57 -6.97 N/A N/A
abacavir NA_A-H11N6 Neuraminidase -7.02 -7.19 -6.78 N/A N/A
Atazanavir NA_A-H11N6 Neuraminidase -7.69 -8.04 -7.28 N/A N/A
Peramivir NA_A-H11N6 Neuraminidase -8.34 -8.06 -7.83 N/A N/A
Fosinopril NA_A-H11N9 Neuraminidase -6.97 -7.80 -7.76 N/A N/A
abacavir NA_A-H11N9 Neuraminidase -6.92 -7.08 -7.15 N/A N/A
Atazanavir NA_A-H11N9 Neuraminidase -5.75 -8.06 -7.96 N/A N/A
Peramivir NA_A-H11N9 Neuraminidase -5.68 -7.96 -7.87 N/A N/A
Fosinopril NA_A-H12N5 Neuraminidase -8.47 -6.72 -6.88 N/A N/A
abacavir NA_A-H12N5 Neuraminidase -7.15 -7.57 -7.42 N/A N/A
Atazanavir NA_A-H12N5 Neuraminidase -6.66 -7.41 -7.65 N/A N/A
Peramivir NA_A-H12N5 Neuraminidase -6.83 -7.56 -7.47 N/A N/A
Fosinopril NA_A-H13N9 Neuraminidase -5.10 N/A N/A N/A N/A
abacavir NA_A-H13N9 Neuraminidase -5.93 N/A N/A N/A N/A
Atazanavir NA_A-H13N9 Neuraminidase -5.77 N/A N/A N/A N/A
Peramivir NA_A-H13N9 Neuraminidase -5.78 N/A N/A N/A N/A
Fosinopril NA_A-H17N10 Neuraminidase -6.83 N/A N/A N/A N/A
abacavir NA_A-H17N10 Neuraminidase -7.46 N/A N/A N/A N/A
Atazanavir NA_A-H17N10 Neuraminidase -6.88 N/A N/A N/A N/A
Peramivir NA_A-H17N10 Neuraminidase -5.83 N/A N/A N/A N/A
Fosinopril NA_A-H18N11 Neuraminidase -6.76 N/A N/A N/A N/A
abacavir NA_A-H18N11 Neuraminidase -6.18 N/A N/A N/A N/A
Atazanavir NA_A-H18N11 Neuraminidase -6.81 N/A N/A N/A N/A
Peramivir NA_A-H18N11 Neuraminidase -5.39 N/A N/A N/A N/A
Fosinopril NA_A-H1N1 Neuraminidase -8.24 N/A N/A N/A N/A
abacavir NA_A-H1N1 Neuraminidase -7.51 N/A N/A N/A N/A
Atazanavir NA_A-H1N1 Neuraminidase -9.01 N/A N/A N/A N/A
Peramivir NA_A-H1N1 Neuraminidase -7.28 N/A N/A N/A N/A
Fosinopril NA_A-H2N2 Neuraminidase -6.94 -8.10 -7.67 N/A N/A
abacavir NA_A-H2N2 Neuraminidase -7.17 -7.47 -7.12 N/A N/A
Atazanavir NA_A-H2N2 Neuraminidase -7.73 -7.82 -8.88 N/A N/A
Peramivir NA_A-H2N2 Neuraminidase -6.71 -6.79 -6.63 N/A N/A
Fosinopril NA_A-H3N2 Ig heavy chain Mem5 -6.90 -6.90 N/A N/A N/A
abacavir NA_A-H3N2 Ig heavy chain Mem5 -6.55 -6.81 N/A N/A N/A
Atazanavir NA_A-H3N2 Ig heavy chain Mem5 -7.94 -6.89 N/A N/A N/A
Peramivir NA_A-H3N2 Ig heavy chain Mem5 -5.69 -6.26 N/A N/A N/A
Fosinopril NA_A-H3N8 Neuraminidase -7.74 -8.67 -7.66 N/A N/A
abacavir NA_A-H3N8 Neuraminidase -7.07 -7.40 -7.41 N/A N/A
Atazanavir NA_A-H3N8 Neuraminidase -7.75 -9.17 -7.17 N/A N/A
Peramivir NA_A-H3N8 Neuraminidase -8.21 -7.86 -7.80 N/A N/A
Fosinopril NA_A-H5N1 Neuraminidase -8.95 N/A N/A N/A N/A
abacavir NA_A-H5N1 Neuraminidase -6.86 N/A N/A N/A N/A
Atazanavir NA_A-H5N1 Neuraminidase -9.21 N/A N/A N/A N/A
Peramivir NA_A-H5N1 Neuraminidase -6.86 N/A N/A N/A N/A
Fosinopril NA_A-H7N9 Neuraminidase -7.45 -7.74 -7.69 N/A N/A
abacavir NA_A-H7N9 Neuraminidase -6.88 -7.01 -7.23 N/A N/A
Atazanavir NA_A-H7N9 Neuraminidase -7.63 -7.55 -7.93 N/A N/A
Peramivir NA_A-H7N9 Neuraminidase -7.73 -7.02 -7.63 N/A N/A
Fosinopril NA_INFB Neuraminidase -6.44 -7.70 N/A 35.24% CHEMBL79499
abacavir NA_INFB Neuraminidase -7.02 -7.23 N/A 26.17% CHEMBL4175983
Atazanavir NA_INFB Neuraminidase -7.35 -8.00 N/A 34.26% CHEMBL318452
Peramivir NA_INFB Neuraminidase -7.16 -7.87 N/A 100.00% CHEMBL139367
Fosinopril NP_A-H1N1 Nucleoprotein -5.11 -7.07 -6.32 N/A N/A
abacavir NP_A-H1N1 Nucleoprotein -6.17 -7.46 -6.88 N/A N/A
Atazanavir NP_A-H1N1 Nucleoprotein -5.34 -6.96 -6.73 N/A N/A
Peramivir NP_A-H1N1 Nucleoprotein -5.57 -5.60 -5.91 N/A N/A
Fosinopril NP_A-H5N1 Nucleoprotein -5.94 N/A N/A N/A N/A
abacavir NP_A-H5N1 Nucleoprotein -6.54 N/A N/A N/A N/A
Atazanavir NP_A-H5N1 Nucleoprotein -6.59 N/A N/A N/A N/A
Peramivir NP_A-H5N1 Nucleoprotein -5.94 N/A N/A N/A N/A
Fosinopril NP_HCoV-NL63 Nucleoprotein -7.29 N/A N/A N/A N/A
abacavir NP_HCoV-NL63 Nucleoprotein -6.51 N/A N/A N/A N/A
Atazanavir NP_HCoV-NL63 Nucleoprotein -7.14 N/A N/A N/A N/A
Peramivir NP_HCoV-NL63 Nucleoprotein -6.06 N/A N/A N/A N/A
Fosinopril NP_HCoV-OC43 Nucleoprotein -8.02 -6.97 -6.89 11.68% CHEMBL3233481
abacavir NP_HCoV-OC43 Nucleoprotein -7.43 -7.17 -6.98 12.12% CHEMBL3233481
Atazanavir NP_HCoV-OC43 Nucleoprotein -8.15 -6.10 -6.97 21.81% CHEMBL3233481
Peramivir NP_HCoV-OC43 Nucleoprotein -5.82 -6.22 -6.46 8.94% CHEMBL3233481
Fosinopril NP_INFB Nucleoprotein -4.97 N/A N/A N/A N/A
abacavir NP_INFB Nucleoprotein -5.19 N/A N/A N/A N/A
Atazanavir NP_INFB Nucleoprotein -5.15 N/A N/A N/A N/A
Peramivir NP_INFB Nucleoprotein -4.27 N/A N/A N/A N/A
Fosinopril NP_INFD NP -4.69 N/A N/A N/A N/A
abacavir NP_INFD NP -5.28 N/A N/A N/A N/A
Atazanavir NP_INFD NP -5.19 N/A N/A N/A N/A
Peramivir NP_INFD NP -4.80 N/A N/A N/A N/A
Fosinopril NP_SARS Nucleoprotein -6.70 N/A N/A N/A N/A
abacavir NP_SARS Nucleoprotein -7.20 N/A N/A N/A N/A
Atazanavir NP_SARS Nucleoprotein -6.83 N/A N/A N/A N/A
Peramivir NP_SARS Nucleoprotein -6.62 N/A N/A N/A N/A
Fosinopril NS3_HCV1A Genome polyprotein -8.02 -5.16 -7.06 29.39% CHEMBL3645759
abacavir NS3_HCV1A Genome polyprotein -7.37 -5.76 -7.61 28.51% CHEMBL3891173
Atazanavir NS3_HCV1A Genome polyprotein -6.57 -5.74 -6.30 40.54% CHEMBL3976363
Peramivir NS3_HCV1A Genome polyprotein -7.22 -6.24 -5.86 50.00% CHEMBL296588
Fosinopril NS3_HCV1B Genome polyprotein -6.50 -7.20 -5.39 32.07% CHEMBL3954962
abacavir NS3_HCV1B Genome polyprotein -6.39 -7.49 -5.78 24.18% CHEMBL297884
Atazanavir NS3_HCV1B Genome polyprotein -9.43 -6.06 -6.12 42.59% CHEMBL1170408
Peramivir NS3_HCV1B Genome polyprotein -7.43 -6.86 -5.39 37.61% CHEMBL3921185
Fosinopril NS3_HCV3A Genome polyprotein -6.42 -6.02 -5.65 N/A N/A
abacavir NS3_HCV3A Genome polyprotein -7.03 -6.81 -6.79 N/A N/A
Atazanavir NS3_HCV3A Genome polyprotein -6.95 -6.24 -6.50 N/A N/A
Peramivir NS3_HCV3A Genome polyprotein -5.95 -6.11 -5.94 N/A N/A
Fosinopril NS5B_HCV1A Genome polyprotein -8.10 -8.45 -8.10 31.65% CHEMBL68034
abacavir NS5B_HCV1A Genome polyprotein -7.32 -7.94 -7.97 28.63% CHEMBL3644939
Atazanavir NS5B_HCV1A Genome polyprotein -8.28 -9.45 -9.42 43.21% CHEMBL353549
Peramivir NS5B_HCV1A Genome polyprotein -6.58 -7.07 -7.33 42.86% CHEMBL13443
Fosinopril NS5B_HCV1B Genome polyprotein -7.39 -7.50 -7.14 26.19% CHEMBL3645202
abacavir NS5B_HCV1B Genome polyprotein -6.92 -7.07 -7.06 24.44% CHEMBL3645202
Atazanavir NS5B_HCV1B Genome polyprotein -8.27 -8.92 -8.44 36.65% CHEMBL3422106
Peramivir NS5B_HCV1B Genome polyprotein -7.14 -6.92 -6.24 22.32% CHEMBL3645202
Fosinopril NS5B_HCV2A Genome polyprotein -9.25 -9.00 N/A N/A N/A
abacavir NS5B_HCV2A Genome polyprotein -8.09 -8.10 N/A N/A N/A
Atazanavir NS5B_HCV2A Genome polyprotein -9.61 -6.02 N/A N/A N/A
Peramivir NS5B_HCV2A Genome polyprotein -7.55 -8.01 N/A N/A N/A
Fosinopril NSP15_SARS Replicase polyprotein 1ab -5.91 N/A N/A 31.75% CHEMBL2441745
abacavir NSP15_SARS Replicase polyprotein 1ab -6.44 N/A N/A 17.00% CHEMBL2441741
Atazanavir NSP15_SARS Replicase polyprotein 1ab -1.79 N/A N/A 42.79% CHEMBL2441745
Peramivir NSP15_SARS Replicase polyprotein 1ab -5.53 N/A N/A 30.61% CHEMBL2441745
Fosinopril NSP1_INFB Non-structural protein 1 -5.86 -5.38 N/A N/A N/A
abacavir NSP1_INFB Non-structural protein 1 -5.43 -5.41 N/A N/A N/A
Atazanavir NSP1_INFB Non-structural protein 1 -6.26 -6.14 N/A N/A N/A
Peramivir NSP1_INFB Non-structural protein 1 -4.58 -5.09 N/A N/A N/A
Fosinopril NSP1_SARS Replicase polyprotein 1ab -6.33 N/A N/A 31.75% CHEMBL2441745
abacavir NSP1_SARS Replicase polyprotein 1ab -6.21 N/A N/A 17.00% CHEMBL2441741
Atazanavir NSP1_SARS Replicase polyprotein 1ab -5.60 N/A N/A 42.79% CHEMBL2441745
Peramivir NSP1_SARS Replicase polyprotein 1ab -5.86 N/A N/A 30.61% CHEMBL2441745
Fosinopril NSP3_HCoV-229E Replicase polyprotein 1a -8.77 N/A N/A N/A N/A
abacavir NSP3_HCoV-229E Replicase polyprotein 1a -8.65 N/A N/A N/A N/A
Atazanavir NSP3_HCoV-229E Replicase polyprotein 1a -7.70 N/A N/A N/A N/A
Peramivir NSP3_HCoV-229E Replicase polyprotein 1a -7.29 N/A N/A N/A N/A
Fosinopril NSP3_IBV Replicase polyprotein 1a -8.41 N/A N/A N/A N/A
abacavir NSP3_IBV Replicase polyprotein 1a -7.78 N/A N/A N/A N/A
Atazanavir NSP3_IBV Replicase polyprotein 1a -6.45 N/A N/A N/A N/A
Peramivir NSP3_IBV Replicase polyprotein 1a -6.91 N/A N/A N/A N/A
Fosinopril NSP3_MHV Replicase polyprotein 1ab -2.96 N/A N/A N/A N/A
abacavir NSP3_MHV Replicase polyprotein 1ab -5.69 N/A N/A N/A N/A
Atazanavir NSP3_MHV Replicase polyprotein 1ab -6.69 N/A N/A N/A N/A
Peramivir NSP3_MHV Replicase polyprotein 1ab -5.78 N/A N/A N/A N/A
Fosinopril NSP9_HCoV-229E Replicase polyprotein 1ab -5.93 -6.36 N/A N/A N/A
abacavir NSP9_HCoV-229E Replicase polyprotein 1ab -5.64 -6.12 N/A N/A N/A
Atazanavir NSP9_HCoV-229E Replicase polyprotein 1ab -6.72 -5.71 N/A N/A N/A
Peramivir NSP9_HCoV-229E Replicase polyprotein 1ab -6.16 -4.88 N/A N/A N/A
Fosinopril PA_A-H17N10 Polymerase acidic protein -6.87 N/A N/A N/A N/A
abacavir PA_A-H17N10 Polymerase acidic protein -7.02 N/A N/A N/A N/A
Atazanavir PA_A-H17N10 Polymerase acidic protein -7.98 N/A N/A N/A N/A
Peramivir PA_A-H17N10 Polymerase acidic protein -6.73 N/A N/A N/A N/A
Fosinopril PA_A-H1N1 Polymerase acidic protein -8.27 -8.28 -7.68 N/A N/A
abacavir PA_A-H1N1 Polymerase acidic protein -7.26 -6.83 -7.28 N/A N/A
Atazanavir PA_A-H1N1 Polymerase acidic protein -9.03 -8.27 -8.20 N/A N/A
Peramivir PA_A-H1N1 Polymerase acidic protein -6.61 -6.71 -6.33 N/A N/A
Fosinopril PA_A-H5N1 Polymerase acidic protein -7.78 -7.55 -7.55 N/A N/A
abacavir PA_A-H5N1 Polymerase acidic protein -7.66 -7.48 -7.57 N/A N/A
Atazanavir PA_A-H5N1 Polymerase acidic protein -8.50 -7.38 -8.78 N/A N/A
Peramivir PA_A-H5N1 Polymerase acidic protein -6.81 -6.62 -6.52 N/A N/A
Fosinopril PA_INFA Polymerase acidic protein -8.15 -7.27 -7.82 26.42% CHEMBL2040554
abacavir PA_INFA Polymerase acidic protein -8.10 -7.32 -7.26 20.81% CHEMBL2040569
Atazanavir PA_INFA Polymerase acidic protein -8.38 -7.80 -8.65 30.61% CHEMBL463590
Peramivir PA_INFA Polymerase acidic protein -6.64 -6.28 -7.05 22.48% CHEMBL2040554
Fosinopril PA_INFB Polymerase acidic protein -7.27 N/A N/A N/A N/A
abacavir PA_INFB Polymerase acidic protein -7.07 N/A N/A N/A N/A
Atazanavir PA_INFB Polymerase acidic protein -7.58 N/A N/A N/A N/A
Peramivir PA_INFB Polymerase acidic protein -6.45 N/A N/A N/A N/A
Fosinopril PB2_A-H3N2 Polymerase basic protein 2 -7.30 -7.28 N/A N/A N/A
abacavir PB2_A-H3N2 Polymerase basic protein 2 -7.53 -7.80 N/A N/A N/A
Atazanavir PB2_A-H3N2 Polymerase basic protein 2 -7.31 -7.26 N/A N/A N/A
Peramivir PB2_A-H3N2 Polymerase basic protein 2 -6.49 -6.71 N/A N/A N/A
Fosinopril PB2_A-H5N1 Polymerase basic protein 2 -6.43 -6.59 -6.75 N/A N/A
abacavir PB2_A-H5N1 Polymerase basic protein 2 -7.69 -6.83 -7.14 N/A N/A
Atazanavir PB2_A-H5N1 Polymerase basic protein 2 -7.50 -7.88 -7.47 N/A N/A
Peramivir PB2_A-H5N1 Polymerase basic protein 2 -6.49 -5.62 -6.39 N/A N/A
Fosinopril PB2_INFB Polymerase basic protein 2 -6.85 N/A N/A N/A N/A
abacavir PB2_INFB Polymerase basic protein 2 -7.17 N/A N/A N/A N/A
Atazanavir PB2_INFB Polymerase basic protein 2 -7.62 N/A N/A N/A N/A
Peramivir PB2_INFB Polymerase basic protein 2 -6.51 N/A N/A N/A N/A
Fosinopril PB3_A-H3N2 Polymerase basic protein 2 -6.85 N/A N/A N/A N/A
abacavir PB3_A-H3N2 Polymerase basic protein 2 -7.91 N/A N/A N/A N/A
Atazanavir PB3_A-H3N2 Polymerase basic protein 2 -7.64 N/A N/A N/A N/A
Peramivir PB3_A-H3N2 Polymerase basic protein 2 -6.48 N/A N/A N/A N/A
Fosinopril PB4_A-H3N2 Polymerase basic protein 2 -7.59 N/A N/A N/A N/A
abacavir PB4_A-H3N2 Polymerase basic protein 2 -7.52 N/A N/A N/A N/A
Atazanavir PB4_A-H3N2 Polymerase basic protein 2 -7.22 N/A N/A N/A N/A
Peramivir PB4_A-H3N2 Polymerase basic protein 2 -6.85 N/A N/A N/A N/A
Fosinopril PLP_SARS Replicase polyprotein 1a -7.90 -7.38 -8.35 30.48% CHEMBL213054
abacavir PLP_SARS Replicase polyprotein 1a -7.47 -8.06 -7.95 19.71% CHEMBL213543
Atazanavir PLP_SARS Replicase polyprotein 1a -8.63 -9.85 -9.63 35.41% CHEMBL213054
Peramivir PLP_SARS Replicase polyprotein 1a -6.58 -6.64 -6.38 31.47% CHEMBL213054
Fosinopril PR_FCoV Replicase polyprotein 1ab -6.90 N/A N/A N/A N/A
abacavir PR_FCoV Replicase polyprotein 1ab -7.21 N/A N/A N/A N/A
Atazanavir PR_FCoV Replicase polyprotein 1ab -7.27 N/A N/A N/A N/A
Peramivir PR_FCoV Replicase polyprotein 1ab -5.90 N/A N/A N/A N/A
Fosinopril PR_HCoV-229E Replicase polyprotein 1a -7.08 -6.21 N/A N/A N/A
abacavir PR_HCoV-229E Replicase polyprotein 1a -6.73 -6.73 N/A N/A N/A
Atazanavir PR_HCoV-229E Replicase polyprotein 1a -7.18 -6.87 N/A N/A N/A
Peramivir PR_HCoV-229E Replicase polyprotein 1a -5.78 -5.78 N/A N/A N/A
Fosinopril PR_HCoV-NL63 Replicase polyprotein 1a -4.28 -7.01 N/A N/A N/A
abacavir PR_HCoV-NL63 Replicase polyprotein 1a -4.93 -7.42 N/A N/A N/A
Atazanavir PR_HCoV-NL63 Replicase polyprotein 1a -4.60 -7.29 N/A N/A N/A
Peramivir PR_HCoV-NL63 Replicase polyprotein 1a -4.46 -6.63 N/A N/A N/A
Fosinopril PR_HIV1 Gag-Pol polyprotein -6.07 -6.56 -6.63 29.17% CHEMBL494499
abacavir PR_HIV1 Gag-Pol polyprotein -6.67 -7.08 -6.45 18.10% CHEMBL503401
Atazanavir PR_HIV1 Gag-Pol polyprotein -6.88 -5.90 -6.29 33.48% CHEMBL510485
Peramivir PR_HIV1 Gag-Pol polyprotein -5.54 -6.20 -5.29 23.39% CHEMBL492666
Fosinopril PR_HIV2 Gag-Pol polyprotein -6.17 -6.18 N/A N/A N/A
abacavir PR_HIV2 Gag-Pol polyprotein -6.91 -6.26 N/A N/A N/A
Atazanavir PR_HIV2 Gag-Pol polyprotein -6.36 -6.57 N/A N/A N/A
Peramivir PR_HIV2 Gag-Pol polyprotein -6.52 -5.72 N/A N/A N/A
Fosinopril PR_HKU1 Replicase polyprotein 1a -5.92 N/A N/A N/A N/A
abacavir PR_HKU1 Replicase polyprotein 1a -6.91 N/A N/A N/A N/A
Atazanavir PR_HKU1 Replicase polyprotein 1a -7.57 N/A N/A N/A N/A
Peramivir PR_HKU1 Replicase polyprotein 1a -6.06 N/A N/A N/A N/A
Fosinopril PR_HKU4 Replicase polyprotein 1ab -6.77 -6.69 -6.86 N/A N/A
abacavir PR_HKU4 Replicase polyprotein 1ab -6.49 -6.97 -6.70 N/A N/A
Atazanavir PR_HKU4 Replicase polyprotein 1ab -6.20 -6.68 -6.75 N/A N/A
Peramivir PR_HKU4 Replicase polyprotein 1ab -5.51 -6.13 -6.84 N/A N/A
Fosinopril PR_IBV Replicase polyprotein 1a -7.33 N/A N/A N/A N/A
abacavir PR_IBV Replicase polyprotein 1a -6.95 N/A N/A N/A N/A
Atazanavir PR_IBV Replicase polyprotein 1a -7.61 N/A N/A N/A N/A
Peramivir PR_IBV Replicase polyprotein 1a -6.18 N/A N/A N/A N/A
Fosinopril PR_MERs 3C-like proteinase -6.49 -7.22 N/A N/A N/A
abacavir PR_MERs 3C-like proteinase -6.94 -7.01 N/A N/A N/A
Atazanavir PR_MERs 3C-like proteinase -6.47 -7.85 N/A N/A N/A
Peramivir PR_MERs 3C-like proteinase -6.26 -5.93 N/A N/A N/A
Fosinopril PR_PEDV 3C-like proteinase -7.56 N/A N/A N/A N/A
abacavir PR_PEDV 3C-like proteinase -6.76 N/A N/A N/A N/A
Atazanavir PR_PEDV 3C-like proteinase -6.93 N/A N/A N/A N/A
Peramivir PR_PEDV 3C-like proteinase -5.86 N/A N/A N/A N/A
Fosinopril PR_SARS Replicase polyprotein 1ab -6.85 -6.54 -7.10 31.75% CHEMBL2441745
abacavir PR_SARS Replicase polyprotein 1ab -6.61 -6.83 -6.79 17.00% CHEMBL2441741
Atazanavir PR_SARS Replicase polyprotein 1ab -7.63 -7.36 -7.42 42.79% CHEMBL2441745
Peramivir PR_SARS Replicase polyprotein 1ab -6.75 -6.14 -6.21 30.61% CHEMBL2441745
Fosinopril PR_SARS2 3C-like protease -6.46 N/A N/A N/A N/A
abacavir PR_SARS2 3C-like protease -7.15 N/A N/A N/A N/A
Atazanavir PR_SARS2 3C-like protease -7.83 N/A N/A N/A N/A
Peramivir PR_SARS2 3C-like protease -6.74 N/A N/A N/A N/A
Fosinopril PR_TGEV Replicase polyprotein 1a -7.00 N/A N/A N/A N/A
abacavir PR_TGEV Replicase polyprotein 1a -6.70 N/A N/A N/A N/A
Atazanavir PR_TGEV Replicase polyprotein 1a -7.61 N/A N/A N/A N/A
Peramivir PR_TGEV Replicase polyprotein 1a -6.04 N/A N/A N/A N/A
Fosinopril RT_HIV1 Gag-Pol polyprotein -8.90 -9.26 -8.34 30.10% CHEMBL3828596
abacavir RT_HIV1 Gag-Pol polyprotein -7.98 -7.56 -8.00 28.89% CHEMBL4227119
Atazanavir RT_HIV1 Gag-Pol polyprotein -8.38 -8.98 -8.54 43.54% CHEMBL4110612
Peramivir RT_HIV1 Gag-Pol polyprotein -7.79 -8.21 -8.41 31.01% CHEMBL3828596
Fosinopril SPIKE_HCoV-229E Spike glycoprotein -5.24 N/A N/A N/A N/A
abacavir SPIKE_HCoV-229E Spike glycoprotein -4.71 N/A N/A N/A N/A
Atazanavir SPIKE_HCoV-229E Spike glycoprotein -4.89 N/A N/A N/A N/A
Peramivir SPIKE_HCoV-229E Spike glycoprotein -4.08 N/A N/A N/A N/A
Fosinopril SPIKE_HCoV-NL63 Spike glycoprotein -5.19 N/A N/A N/A N/A
abacavir SPIKE_HCoV-NL63 Spike glycoprotein -5.25 N/A N/A N/A N/A
Atazanavir SPIKE_HCoV-NL63 Spike glycoprotein -6.12 N/A N/A N/A N/A
Peramivir SPIKE_HCoV-NL63 Spike glycoprotein -4.86 N/A N/A N/A N/A
Fosinopril SPIKE_HCoV-OC43 Spike glycoprotein -5.56 N/A N/A N/A N/A
abacavir SPIKE_HCoV-OC43 Spike glycoprotein -6.00 N/A N/A N/A N/A
Atazanavir SPIKE_HCoV-OC43 Spike glycoprotein -6.56 N/A N/A N/A N/A
Peramivir SPIKE_HCoV-OC43 Spike glycoprotein -5.49 N/A N/A N/A N/A
Fosinopril SPIKE_HKU4 Spike glycoprotein -5.74 N/A N/A N/A N/A
abacavir SPIKE_HKU4 Spike glycoprotein -6.22 N/A N/A N/A N/A
Atazanavir SPIKE_HKU4 Spike glycoprotein -5.89 N/A N/A N/A N/A
Peramivir SPIKE_HKU4 Spike glycoprotein -5.81 N/A N/A N/A N/A
Fosinopril SPIKE_IBV Spike glycoprotein -6.53 N/A N/A N/A N/A
abacavir SPIKE_IBV Spike glycoprotein -5.71 N/A N/A N/A N/A
Atazanavir SPIKE_IBV Spike glycoprotein -5.47 N/A N/A N/A N/A
Peramivir SPIKE_IBV Spike glycoprotein -5.38 N/A N/A N/A N/A
Fosinopril SPIKE_MERs Spike glycoprotein -6.43 -6.06 -4.96 N/A N/A
abacavir SPIKE_MERs Spike glycoprotein -6.23 -5.48 -4.91 N/A N/A
Atazanavir SPIKE_MERs Spike glycoprotein -6.18 -6.74 -5.20 N/A N/A
Peramivir SPIKE_MERs Spike glycoprotein -6.64 -6.64 -4.97 N/A N/A
Fosinopril SPIKE_MHV Spike glycoprotein -7.28 N/A N/A N/A N/A
abacavir SPIKE_MHV Spike glycoprotein -6.36 N/A N/A N/A N/A
Atazanavir SPIKE_MHV Spike glycoprotein -6.42 N/A N/A N/A N/A
Peramivir SPIKE_MHV Spike glycoprotein -6.66 N/A N/A N/A N/A
Fosinopril SPIKE_PDCoV Spike protein -5.93 N/A N/A N/A N/A
abacavir SPIKE_PDCoV Spike protein -6.84 N/A N/A N/A N/A
Atazanavir SPIKE_PDCoV Spike protein -5.91 N/A N/A N/A N/A
Peramivir SPIKE_PDCoV Spike protein -5.45 N/A N/A N/A N/A
Fosinopril SPIKE_SARS Spike glycoprotein -5.55 -5.21 N/A N/A N/A
abacavir SPIKE_SARS Spike glycoprotein -6.18 -6.37 N/A N/A N/A
Atazanavir SPIKE_SARS Spike glycoprotein -5.97 -5.68 N/A N/A N/A
Peramivir SPIKE_SARS Spike glycoprotein -5.27 -6.38 N/A N/A N/A
Fosinopril SPIKE_SARS2 Spike glycoprotein -5.32 N/A N/A N/A N/A
abacavir SPIKE_SARS2 Spike glycoprotein -5.47 N/A N/A N/A N/A
Atazanavir SPIKE_SARS2 Spike glycoprotein -5.69 N/A N/A N/A N/A
Peramivir SPIKE_SARS2 Spike glycoprotein -5.20 N/A N/A N/A N/A