Mercaptopurine_melatonin_asiprin #157 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
asiprin GP160_HIV1 Envelope glycoprotein gp160 -6.28 -5.12 -5.67 N/A N/A
Mercaptopurine GP160_HIV1 Envelope glycoprotein gp160 -5.37 -5.40 -4.75 N/A N/A
melatonin GP160_HIV1 Envelope glycoprotein gp160 -5.99 -5.93 -6.10 N/A N/A
asiprin GP160_HIV2 Envelope glycoprotein gp160 -5.68 N/A N/A N/A N/A
Mercaptopurine GP160_HIV2 Envelope glycoprotein gp160 -4.91 N/A N/A N/A N/A
melatonin GP160_HIV2 Envelope glycoprotein gp160 -5.61 N/A N/A N/A N/A
asiprin GP_EBOV Envelope glycoprotein -5.33 -5.46 -5.38 14.23% CHEMBL3125895
Mercaptopurine GP_EBOV Envelope glycoprotein -4.61 -4.15 -4.25 11.76% CHEMBL3125895
melatonin GP_EBOV Envelope glycoprotein -6.60 -6.18 -6.50 34.07% CHEMBL3125895
asiprin HA_A-H10N7 Hemagglutinin -5.46 N/A N/A N/A N/A
Mercaptopurine HA_A-H10N7 Hemagglutinin -4.59 N/A N/A N/A N/A
melatonin HA_A-H10N7 Hemagglutinin -5.59 N/A N/A N/A N/A
asiprin HA_A-H10N8 Hemagglutinin -5.03 N/A N/A N/A N/A
Mercaptopurine HA_A-H10N8 Hemagglutinin -3.72 N/A N/A N/A N/A
melatonin HA_A-H10N8 Hemagglutinin -5.10 N/A N/A N/A N/A
asiprin HA_A-H13N6 Hemagglutinin -5.43 N/A N/A N/A N/A
Mercaptopurine HA_A-H13N6 Hemagglutinin -4.56 N/A N/A N/A N/A
melatonin HA_A-H13N6 Hemagglutinin -6.05 N/A N/A N/A N/A
asiprin HA_A-H14N6 Hemagglutinin -5.03 N/A N/A N/A N/A
Mercaptopurine HA_A-H14N6 Hemagglutinin -5.07 N/A N/A N/A N/A
melatonin HA_A-H14N6 Hemagglutinin -5.42 N/A N/A N/A N/A
asiprin HA_A-H15N9 Hemagglutinin -5.57 N/A N/A N/A N/A
Mercaptopurine HA_A-H15N9 Hemagglutinin -4.77 N/A N/A N/A N/A
melatonin HA_A-H15N9 Hemagglutinin -5.70 N/A N/A N/A N/A
asiprin HA_A-H17N10 Hemagglutinin -4.35 N/A N/A N/A N/A
Mercaptopurine HA_A-H17N10 Hemagglutinin -4.01 N/A N/A N/A N/A
melatonin HA_A-H17N10 Hemagglutinin -5.20 N/A N/A N/A N/A
asiprin HA_A-H18N11 Hemagglutinin -4.42 N/A N/A N/A N/A
Mercaptopurine HA_A-H18N11 Hemagglutinin -4.36 N/A N/A N/A N/A
melatonin HA_A-H18N11 Hemagglutinin -4.59 N/A N/A N/A N/A
asiprin HA_A-H1N1 Hemagglutinin -5.13 -5.03 N/A N/A N/A
Mercaptopurine HA_A-H1N1 Hemagglutinin -4.58 -4.27 N/A N/A N/A
melatonin HA_A-H1N1 Hemagglutinin -5.33 -5.26 N/A N/A N/A
asiprin HA_A-H2N2 Hemagglutinin -4.88 -5.11 N/A N/A N/A
Mercaptopurine HA_A-H2N2 Hemagglutinin -4.76 -5.22 N/A N/A N/A
melatonin HA_A-H2N2 Hemagglutinin -5.24 -5.34 N/A N/A N/A
asiprin HA_A-H3N2 Hemagglutinin -5.06 -5.13 -4.94 N/A N/A
Mercaptopurine HA_A-H3N2 Hemagglutinin -4.91 -4.17 -4.10 N/A N/A
melatonin HA_A-H3N2 Hemagglutinin -5.25 -5.02 -5.17 N/A N/A
asiprin HA_A-H3N8 Hemagglutinin -4.44 -4.74 -4.76 N/A N/A
Mercaptopurine HA_A-H3N8 Hemagglutinin -3.90 -4.21 -4.23 N/A N/A
melatonin HA_A-H3N8 Hemagglutinin -4.98 -5.30 -4.95 N/A N/A
asiprin HA_A-H5N1 Hemagglutinin -5.28 -5.59 -6.02 N/A N/A
Mercaptopurine HA_A-H5N1 Hemagglutinin -5.19 -5.31 -4.76 N/A N/A
melatonin HA_A-H5N1 Hemagglutinin -5.58 -5.95 -6.04 N/A N/A
asiprin HA_A-H5N3 Hemagglutinin -5.38 -5.14 N/A N/A N/A
Mercaptopurine HA_A-H5N3 Hemagglutinin -5.28 -4.60 N/A N/A N/A
melatonin HA_A-H5N3 Hemagglutinin -5.86 -5.42 N/A N/A N/A
asiprin HA_A-H6N1 Hemagglutinin -5.03 N/A N/A N/A N/A
Mercaptopurine HA_A-H6N1 Hemagglutinin -3.72 N/A N/A N/A N/A
melatonin HA_A-H6N1 Hemagglutinin -5.10 N/A N/A N/A N/A
asiprin HA_A-H6N6 Hemagglutinin -5.23 N/A N/A N/A N/A
Mercaptopurine HA_A-H6N6 Hemagglutinin -4.90 N/A N/A N/A N/A
melatonin HA_A-H6N6 Hemagglutinin -5.18 N/A N/A N/A N/A
asiprin HA_A-H7N2 Hemagglutinin -5.00 -4.62 -5.23 N/A N/A
Mercaptopurine HA_A-H7N2 Hemagglutinin -4.25 -3.98 -4.53 N/A N/A
melatonin HA_A-H7N2 Hemagglutinin -5.47 -5.08 -5.36 N/A N/A
asiprin HA_A-H7N7 Hemagglutinin -4.88 -5.18 N/A N/A N/A
Mercaptopurine HA_A-H7N7 Hemagglutinin -4.40 -4.40 N/A N/A N/A
melatonin HA_A-H7N7 Hemagglutinin -5.69 -5.62 N/A N/A N/A
asiprin HA_A-H7N9 Hemagglutinin -5.32 N/A N/A N/A N/A
Mercaptopurine HA_A-H7N9 Hemagglutinin -5.12 N/A N/A N/A N/A
melatonin HA_A-H7N9 Hemagglutinin -5.51 N/A N/A N/A N/A
asiprin HA_INFB Hemagglutinin -5.17 -5.15 N/A N/A N/A
Mercaptopurine HA_INFB Hemagglutinin -4.36 -4.28 N/A N/A N/A
melatonin HA_INFB Hemagglutinin -5.62 -5.10 N/A N/A N/A
asiprin HA_INFD Hemagglutinin-esterase-fusion glycoprotein -4.27 N/A N/A N/A N/A
Mercaptopurine HA_INFD Hemagglutinin-esterase-fusion glycoprotein -3.70 N/A N/A N/A N/A
melatonin HA_INFD Hemagglutinin-esterase-fusion glycoprotein -5.51 N/A N/A N/A N/A
asiprin HE_BCV Hemagglutinin-esterase -6.58 -5.28 N/A N/A N/A
Mercaptopurine HE_BCV Hemagglutinin-esterase -5.33 -4.48 N/A N/A N/A
melatonin HE_BCV Hemagglutinin-esterase -6.10 -5.31 N/A N/A N/A
asiprin HE_HCoV-OC43 Hemagglutinin-esterase -4.63 N/A N/A N/A N/A
Mercaptopurine HE_HCoV-OC43 Hemagglutinin-esterase -3.91 N/A N/A N/A N/A
melatonin HE_HCoV-OC43 Hemagglutinin-esterase -5.07 N/A N/A N/A N/A
asiprin HE_MHV Hemagglutinin-esterase -4.68 N/A N/A N/A N/A
Mercaptopurine HE_MHV Hemagglutinin-esterase -4.16 N/A N/A N/A N/A
melatonin HE_MHV Hemagglutinin-esterase -5.13 N/A N/A N/A N/A
asiprin IN_HIV1 Gag-Pol polyprotein -4.15 -4.41 N/A N/A N/A
Mercaptopurine IN_HIV1 Gag-Pol polyprotein -3.35 -3.79 N/A N/A N/A
melatonin IN_HIV1 Gag-Pol polyprotein -4.96 -4.91 N/A N/A N/A
asiprin MD_HKU4 Replicase polyprotein 1ab -6.80 -6.36 -6.14 N/A N/A
Mercaptopurine MD_HKU4 Replicase polyprotein 1ab -4.65 -5.00 -4.96 N/A N/A
melatonin MD_HKU4 Replicase polyprotein 1ab -7.28 -7.31 -7.31 N/A N/A
asiprin MD_MERs Replicase polyprotein 1a -6.88 -6.35 N/A N/A N/A
Mercaptopurine MD_MERs Replicase polyprotein 1a -4.80 -5.08 N/A N/A N/A
melatonin MD_MERs Replicase polyprotein 1a -7.28 -6.96 N/A N/A N/A
asiprin MX2_A-H5N1 Matrix protein 2 -6.72 N/A N/A N/A N/A
Mercaptopurine MX2_A-H5N1 Matrix protein 2 -5.79 N/A N/A N/A N/A
melatonin MX2_A-H5N1 Matrix protein 2 -7.42 N/A N/A N/A N/A
asiprin NA_A-H11N6 Neuraminidase -5.58 -5.68 -5.65 N/A N/A
Mercaptopurine NA_A-H11N6 Neuraminidase -5.06 -5.20 -5.04 N/A N/A
melatonin NA_A-H11N6 Neuraminidase -6.54 -6.86 -6.60 N/A N/A
asiprin NA_A-H11N9 Neuraminidase -5.88 -6.01 -5.56 N/A N/A
Mercaptopurine NA_A-H11N9 Neuraminidase -4.72 -5.13 -5.07 N/A N/A
melatonin NA_A-H11N9 Neuraminidase -4.71 -6.36 -6.48 N/A N/A
asiprin NA_A-H12N5 Neuraminidase -6.11 -5.57 -5.60 N/A N/A
Mercaptopurine NA_A-H12N5 Neuraminidase -4.97 -5.19 -5.18 N/A N/A
melatonin NA_A-H12N5 Neuraminidase -6.60 -6.25 -6.26 N/A N/A
asiprin NA_A-H13N9 Neuraminidase -5.24 N/A N/A N/A N/A
Mercaptopurine NA_A-H13N9 Neuraminidase -4.68 N/A N/A N/A N/A
melatonin NA_A-H13N9 Neuraminidase -5.41 N/A N/A N/A N/A
asiprin NA_A-H17N10 Neuraminidase -5.39 N/A N/A N/A N/A
Mercaptopurine NA_A-H17N10 Neuraminidase -4.59 N/A N/A N/A N/A
melatonin NA_A-H17N10 Neuraminidase -5.83 N/A N/A N/A N/A
asiprin NA_A-H18N11 Neuraminidase -4.72 N/A N/A N/A N/A
Mercaptopurine NA_A-H18N11 Neuraminidase -4.10 N/A N/A N/A N/A
melatonin NA_A-H18N11 Neuraminidase -5.64 N/A N/A N/A N/A
asiprin NA_A-H1N1 Neuraminidase -5.67 N/A N/A N/A N/A
Mercaptopurine NA_A-H1N1 Neuraminidase -4.90 N/A N/A N/A N/A
melatonin NA_A-H1N1 Neuraminidase -6.36 N/A N/A N/A N/A
asiprin NA_A-H2N2 Neuraminidase -5.90 -5.87 -5.94 N/A N/A
Mercaptopurine NA_A-H2N2 Neuraminidase -5.24 -5.29 -4.82 N/A N/A
melatonin NA_A-H2N2 Neuraminidase -6.28 -5.77 -6.10 N/A N/A
asiprin NA_A-H3N2 Ig heavy chain Mem5 -5.42 -5.42 N/A N/A N/A
Mercaptopurine NA_A-H3N2 Ig heavy chain Mem5 -4.40 -4.67 N/A N/A N/A
melatonin NA_A-H3N2 Ig heavy chain Mem5 -6.37 -5.49 N/A N/A N/A
asiprin NA_A-H3N8 Neuraminidase -5.34 -6.41 -5.89 N/A N/A
Mercaptopurine NA_A-H3N8 Neuraminidase -5.01 -5.20 -5.06 N/A N/A
melatonin NA_A-H3N8 Neuraminidase -6.50 -6.62 -6.68 N/A N/A
asiprin NA_A-H5N1 Neuraminidase -5.80 N/A N/A N/A N/A
Mercaptopurine NA_A-H5N1 Neuraminidase -4.99 N/A N/A N/A N/A
melatonin NA_A-H5N1 Neuraminidase -6.49 N/A N/A N/A N/A
asiprin NA_A-H7N9 Neuraminidase -5.50 -5.63 -5.60 N/A N/A
Mercaptopurine NA_A-H7N9 Neuraminidase -4.96 -5.21 -5.24 N/A N/A
melatonin NA_A-H7N9 Neuraminidase -6.00 -6.16 -6.10 N/A N/A
asiprin NA_INFB Neuraminidase -5.91 -5.98 N/A 14.56% CHEMBL79499
Mercaptopurine NA_INFB Neuraminidase -4.95 -5.10 N/A 14.63% CHEMBL195288
melatonin NA_INFB Neuraminidase -6.28 -6.78 N/A 24.69% CHEMBL362993
asiprin NP_A-H1N1 Nucleoprotein -5.36 -5.70 -5.84 N/A N/A
Mercaptopurine NP_A-H1N1 Nucleoprotein -4.18 -4.35 -5.23 N/A N/A
melatonin NP_A-H1N1 Nucleoprotein -5.54 -7.34 -6.05 N/A N/A
asiprin NP_A-H5N1 Nucleoprotein -5.54 N/A N/A N/A N/A
Mercaptopurine NP_A-H5N1 Nucleoprotein -4.96 N/A N/A N/A N/A
melatonin NP_A-H5N1 Nucleoprotein -6.19 N/A N/A N/A N/A
asiprin NP_HCoV-NL63 Nucleoprotein -5.01 N/A N/A N/A N/A
Mercaptopurine NP_HCoV-NL63 Nucleoprotein -4.45 N/A N/A N/A N/A
melatonin NP_HCoV-NL63 Nucleoprotein -6.03 N/A N/A N/A N/A
asiprin NP_HCoV-OC43 Nucleoprotein -6.55 -5.79 -5.75 10.38% CHEMBL3233481
Mercaptopurine NP_HCoV-OC43 Nucleoprotein -5.62 -4.66 -4.64 11.11% CHEMBL3233481
melatonin NP_HCoV-OC43 Nucleoprotein -7.47 -6.46 -6.04 26.72% CHEMBL3233481
asiprin NP_INFB Nucleoprotein -4.22 N/A N/A N/A N/A
Mercaptopurine NP_INFB Nucleoprotein -3.54 N/A N/A N/A N/A
melatonin NP_INFB Nucleoprotein -4.13 N/A N/A N/A N/A
asiprin NP_INFD NP -4.35 N/A N/A N/A N/A
Mercaptopurine NP_INFD NP -3.52 N/A N/A N/A N/A
melatonin NP_INFD NP -4.86 N/A N/A N/A N/A
asiprin NP_SARS Nucleoprotein -5.51 N/A N/A N/A N/A
Mercaptopurine NP_SARS Nucleoprotein -5.05 N/A N/A N/A N/A
melatonin NP_SARS Nucleoprotein -6.41 N/A N/A N/A N/A
asiprin NS3_HCV1A Genome polyprotein -5.85 -6.08 -6.08 33.33% CHEMBL4107993
Mercaptopurine NS3_HCV1A Genome polyprotein -4.91 -4.49 -4.86 18.37% CHEMBL3696817
melatonin NS3_HCV1A Genome polyprotein -6.10 -5.61 -6.69 38.89% CHEMBL3948676
asiprin NS3_HCV1B Genome polyprotein -5.92 -5.14 -5.79 15.86% CHEMBL1170408
Mercaptopurine NS3_HCV1B Genome polyprotein -4.86 -4.77 -4.38 10.78% CHEMBL3125634
melatonin NS3_HCV1B Genome polyprotein -6.41 -6.38 -5.11 31.39% CHEMBL1170408
asiprin NS3_HCV3A Genome polyprotein -5.88 -5.90 -5.85 N/A N/A
Mercaptopurine NS3_HCV3A Genome polyprotein -5.02 -5.08 -5.08 N/A N/A
melatonin NS3_HCV3A Genome polyprotein -6.48 -6.43 -5.95 N/A N/A
asiprin NS5B_HCV1A Genome polyprotein -6.13 -7.39 -7.02 31.30% CHEMBL446360
Mercaptopurine NS5B_HCV1A Genome polyprotein -5.39 -5.39 -5.37 14.50% CHEMBL353549
melatonin NS5B_HCV1A Genome polyprotein -6.46 -7.38 -7.18 35.97% CHEMBL363650
asiprin NS5B_HCV1B Genome polyprotein -5.75 -6.16 -5.93 19.70% CHEMBL3645180
Mercaptopurine NS5B_HCV1B Genome polyprotein -5.02 -5.13 -4.86 16.13% CHEMBL99408
melatonin NS5B_HCV1B Genome polyprotein -6.43 -7.18 -6.59 31.88% CHEMBL3645180
asiprin NS5B_HCV2A Genome polyprotein -6.63 -6.55 N/A N/A N/A
Mercaptopurine NS5B_HCV2A Genome polyprotein -5.19 -5.52 N/A N/A N/A
melatonin NS5B_HCV2A Genome polyprotein -7.32 -7.59 N/A N/A N/A
asiprin NSP15_SARS Replicase polyprotein 1ab -5.75 N/A N/A 29.57% CHEMBL221366
Mercaptopurine NSP15_SARS Replicase polyprotein 1ab -4.33 N/A N/A 14.52% CHEMBL221366
melatonin NSP15_SARS Replicase polyprotein 1ab -5.66 N/A N/A 26.45% CHEMBL2441741
asiprin NSP1_INFB Non-structural protein 1 -4.43 -4.02 N/A N/A N/A
Mercaptopurine NSP1_INFB Non-structural protein 1 -3.61 -3.68 N/A N/A N/A
melatonin NSP1_INFB Non-structural protein 1 -5.57 -5.60 N/A N/A N/A
asiprin NSP1_SARS Replicase polyprotein 1ab -5.10 N/A N/A 29.57% CHEMBL221366
Mercaptopurine NSP1_SARS Replicase polyprotein 1ab -4.64 N/A N/A 14.52% CHEMBL221366
melatonin NSP1_SARS Replicase polyprotein 1ab -5.68 N/A N/A 26.45% CHEMBL2441741
asiprin NSP3_HCoV-229E Replicase polyprotein 1a -6.62 N/A N/A N/A N/A
Mercaptopurine NSP3_HCoV-229E Replicase polyprotein 1a -5.08 N/A N/A N/A N/A
melatonin NSP3_HCoV-229E Replicase polyprotein 1a -7.41 N/A N/A N/A N/A
asiprin NSP3_IBV Replicase polyprotein 1a -6.49 N/A N/A N/A N/A
Mercaptopurine NSP3_IBV Replicase polyprotein 1a -5.18 N/A N/A N/A N/A
melatonin NSP3_IBV Replicase polyprotein 1a -7.03 N/A N/A N/A N/A
asiprin NSP3_MHV Replicase polyprotein 1ab -5.38 N/A N/A N/A N/A
Mercaptopurine NSP3_MHV Replicase polyprotein 1ab -4.87 N/A N/A N/A N/A
melatonin NSP3_MHV Replicase polyprotein 1ab -5.96 N/A N/A N/A N/A
asiprin NSP9_HCoV-229E Replicase polyprotein 1ab -5.54 -5.55 N/A N/A N/A
Mercaptopurine NSP9_HCoV-229E Replicase polyprotein 1ab -4.20 -4.16 N/A N/A N/A
melatonin NSP9_HCoV-229E Replicase polyprotein 1ab -5.94 -5.67 N/A N/A N/A
asiprin PA_A-H17N10 Polymerase acidic protein -5.59 N/A N/A N/A N/A
Mercaptopurine PA_A-H17N10 Polymerase acidic protein -4.66 N/A N/A N/A N/A
melatonin PA_A-H17N10 Polymerase acidic protein -6.29 N/A N/A N/A N/A
asiprin PA_A-H1N1 Polymerase acidic protein -5.40 -5.84 -5.35 N/A N/A
Mercaptopurine PA_A-H1N1 Polymerase acidic protein -5.15 -5.32 -4.82 N/A N/A
melatonin PA_A-H1N1 Polymerase acidic protein -6.25 -6.59 -6.21 N/A N/A
asiprin PA_A-H5N1 Polymerase acidic protein -5.93 -5.72 -5.50 N/A N/A
Mercaptopurine PA_A-H5N1 Polymerase acidic protein -5.11 -4.83 -4.93 N/A N/A
melatonin PA_A-H5N1 Polymerase acidic protein -6.77 -6.39 -6.51 N/A N/A
asiprin PA_INFA Polymerase acidic protein -6.81 -5.31 -5.44 39.56% CHEMBL3600947
Mercaptopurine PA_INFA Polymerase acidic protein -5.46 -4.89 -4.72 15.20% CHEMBL2040578
melatonin PA_INFA Polymerase acidic protein -7.18 -6.05 -6.28 30.77% CHEMBL573638
asiprin PA_INFB Polymerase acidic protein -5.67 N/A N/A N/A N/A
Mercaptopurine PA_INFB Polymerase acidic protein -4.84 N/A N/A N/A N/A
melatonin PA_INFB Polymerase acidic protein -6.21 N/A N/A N/A N/A
asiprin PB2_A-H3N2 Polymerase basic protein 2 -6.03 -6.07 N/A N/A N/A
Mercaptopurine PB2_A-H3N2 Polymerase basic protein 2 -4.76 -4.61 N/A N/A N/A
melatonin PB2_A-H3N2 Polymerase basic protein 2 -6.39 -6.90 N/A N/A N/A
asiprin PB2_A-H5N1 Polymerase basic protein 2 -5.63 -5.57 -6.04 N/A N/A
Mercaptopurine PB2_A-H5N1 Polymerase basic protein 2 -4.53 -4.70 -4.67 N/A N/A
melatonin PB2_A-H5N1 Polymerase basic protein 2 -6.40 -6.53 -6.84 N/A N/A
asiprin PB2_INFB Polymerase basic protein 2 -6.00 N/A N/A N/A N/A
Mercaptopurine PB2_INFB Polymerase basic protein 2 -4.80 N/A N/A N/A N/A
melatonin PB2_INFB Polymerase basic protein 2 -6.88 N/A N/A N/A N/A
asiprin PB3_A-H3N2 Polymerase basic protein 2 -5.92 N/A N/A N/A N/A
Mercaptopurine PB3_A-H3N2 Polymerase basic protein 2 -4.77 N/A N/A N/A N/A
melatonin PB3_A-H3N2 Polymerase basic protein 2 -6.87 N/A N/A N/A N/A
asiprin PB4_A-H3N2 Polymerase basic protein 2 -6.00 N/A N/A N/A N/A
Mercaptopurine PB4_A-H3N2 Polymerase basic protein 2 -4.82 N/A N/A N/A N/A
melatonin PB4_A-H3N2 Polymerase basic protein 2 -7.18 N/A N/A N/A N/A
asiprin PLP_SARS Replicase polyprotein 1a -6.70 -6.71 -6.30 40.95% CHEMBL222735
Mercaptopurine PLP_SARS Replicase polyprotein 1a -5.59 -5.81 -5.94 13.71% CHEMBL222735
melatonin PLP_SARS Replicase polyprotein 1a -7.15 -7.48 -7.69 34.27% CHEMBL358279
asiprin PR_FCoV Replicase polyprotein 1ab -4.85 N/A N/A N/A N/A
Mercaptopurine PR_FCoV Replicase polyprotein 1ab -4.68 N/A N/A N/A N/A
melatonin PR_FCoV Replicase polyprotein 1ab -5.99 N/A N/A N/A N/A
asiprin PR_HCoV-229E Replicase polyprotein 1a -4.83 -4.56 N/A N/A N/A
Mercaptopurine PR_HCoV-229E Replicase polyprotein 1a -4.54 -4.61 N/A N/A N/A
melatonin PR_HCoV-229E Replicase polyprotein 1a -5.97 -5.46 N/A N/A N/A
asiprin PR_HCoV-NL63 Replicase polyprotein 1a -5.09 -5.19 N/A N/A N/A
Mercaptopurine PR_HCoV-NL63 Replicase polyprotein 1a -3.91 -4.67 N/A N/A N/A
melatonin PR_HCoV-NL63 Replicase polyprotein 1a -5.32 -6.01 N/A N/A N/A
asiprin PR_HIV1 Gag-Pol polyprotein -4.76 -5.20 -5.08 17.82% CHEMBL450294
Mercaptopurine PR_HIV1 Gag-Pol polyprotein -3.98 -4.38 -4.04 10.34% CHEMBL510485
melatonin PR_HIV1 Gag-Pol polyprotein -5.83 -5.67 -6.13 28.00% CHEMBL492666
asiprin PR_HIV2 Gag-Pol polyprotein -5.31 -4.86 N/A N/A N/A
Mercaptopurine PR_HIV2 Gag-Pol polyprotein -4.87 -3.87 N/A N/A N/A
melatonin PR_HIV2 Gag-Pol polyprotein -6.36 -5.65 N/A N/A N/A
asiprin PR_HKU1 Replicase polyprotein 1a -5.16 N/A N/A N/A N/A
Mercaptopurine PR_HKU1 Replicase polyprotein 1a -5.20 N/A N/A N/A N/A
melatonin PR_HKU1 Replicase polyprotein 1a -5.46 N/A N/A N/A N/A
asiprin PR_HKU4 Replicase polyprotein 1ab -4.73 -5.43 -5.11 N/A N/A
Mercaptopurine PR_HKU4 Replicase polyprotein 1ab -4.70 -4.91 -4.68 N/A N/A
melatonin PR_HKU4 Replicase polyprotein 1ab -5.76 -6.07 -6.21 N/A N/A
asiprin PR_IBV Replicase polyprotein 1a -5.03 N/A N/A N/A N/A
Mercaptopurine PR_IBV Replicase polyprotein 1a -4.44 N/A N/A N/A N/A
melatonin PR_IBV Replicase polyprotein 1a -6.22 N/A N/A N/A N/A
asiprin PR_MERs 3C-like proteinase -5.53 -5.14 N/A N/A N/A
Mercaptopurine PR_MERs 3C-like proteinase -4.88 -5.01 N/A N/A N/A
melatonin PR_MERs 3C-like proteinase -6.20 -6.50 N/A N/A N/A
asiprin PR_PEDV 3C-like proteinase -5.10 N/A N/A N/A N/A
Mercaptopurine PR_PEDV 3C-like proteinase -4.73 N/A N/A N/A N/A
melatonin PR_PEDV 3C-like proteinase -5.67 N/A N/A N/A N/A
asiprin PR_SARS Replicase polyprotein 1ab -5.48 -5.35 -5.17 29.57% CHEMBL221366
Mercaptopurine PR_SARS Replicase polyprotein 1ab -4.57 -5.08 -4.74 14.52% CHEMBL221366
melatonin PR_SARS Replicase polyprotein 1ab -5.53 -6.14 -5.93 26.45% CHEMBL2441741
asiprin PR_SARS2 3C-like protease -5.13 N/A N/A N/A N/A
Mercaptopurine PR_SARS2 3C-like protease -4.62 N/A N/A N/A N/A
melatonin PR_SARS2 3C-like protease -6.10 N/A N/A N/A N/A
asiprin PR_TGEV Replicase polyprotein 1a -5.51 N/A N/A N/A N/A
Mercaptopurine PR_TGEV Replicase polyprotein 1a -4.62 N/A N/A N/A N/A
melatonin PR_TGEV Replicase polyprotein 1a -6.12 N/A N/A N/A N/A
asiprin RT_HIV1 Gag-Pol polyprotein -6.92 -6.85 -7.01 23.36% CHEMBL3775172
Mercaptopurine RT_HIV1 Gag-Pol polyprotein -5.43 -5.18 -5.53 18.18% CHEMBL4288759
melatonin RT_HIV1 Gag-Pol polyprotein -8.20 -8.24 -8.19 30.52% CHEMBL4227326
asiprin SPIKE_HCoV-229E Spike glycoprotein -4.15 N/A N/A N/A N/A
Mercaptopurine SPIKE_HCoV-229E Spike glycoprotein -3.25 N/A N/A N/A N/A
melatonin SPIKE_HCoV-229E Spike glycoprotein -4.19 N/A N/A N/A N/A
asiprin SPIKE_HCoV-NL63 Spike glycoprotein -4.60 N/A N/A N/A N/A
Mercaptopurine SPIKE_HCoV-NL63 Spike glycoprotein -3.63 N/A N/A N/A N/A
melatonin SPIKE_HCoV-NL63 Spike glycoprotein -5.35 N/A N/A N/A N/A
asiprin SPIKE_HCoV-OC43 Spike glycoprotein -4.78 N/A N/A N/A N/A
Mercaptopurine SPIKE_HCoV-OC43 Spike glycoprotein -4.41 N/A N/A N/A N/A
melatonin SPIKE_HCoV-OC43 Spike glycoprotein -5.08 N/A N/A N/A N/A
asiprin SPIKE_HKU4 Spike glycoprotein -5.60 N/A N/A N/A N/A
Mercaptopurine SPIKE_HKU4 Spike glycoprotein -4.90 N/A N/A N/A N/A
melatonin SPIKE_HKU4 Spike glycoprotein -5.70 N/A N/A N/A N/A
asiprin SPIKE_IBV Spike glycoprotein -4.94 N/A N/A N/A N/A
Mercaptopurine SPIKE_IBV Spike glycoprotein -4.18 N/A N/A N/A N/A
melatonin SPIKE_IBV Spike glycoprotein -5.23 N/A N/A N/A N/A
asiprin SPIKE_MERs Spike glycoprotein -5.73 -5.14 -4.40 N/A N/A
Mercaptopurine SPIKE_MERs Spike glycoprotein -4.57 -4.76 -3.94 N/A N/A
melatonin SPIKE_MERs Spike glycoprotein -5.40 -5.33 -4.54 N/A N/A
asiprin SPIKE_MHV Spike glycoprotein -5.85 N/A N/A N/A N/A
Mercaptopurine SPIKE_MHV Spike glycoprotein -4.59 N/A N/A N/A N/A
melatonin SPIKE_MHV Spike glycoprotein -5.46 N/A N/A N/A N/A
asiprin SPIKE_PDCoV Spike protein -5.13 N/A N/A N/A N/A
Mercaptopurine SPIKE_PDCoV Spike protein -4.21 N/A N/A N/A N/A
melatonin SPIKE_PDCoV Spike protein -5.63 N/A N/A N/A N/A
asiprin SPIKE_SARS Spike glycoprotein -4.93 -5.17 N/A N/A N/A
Mercaptopurine SPIKE_SARS Spike glycoprotein -4.15 -3.75 N/A N/A N/A
melatonin SPIKE_SARS Spike glycoprotein -5.36 -5.61 N/A N/A N/A
asiprin SPIKE_SARS2 Spike glycoprotein -4.76 N/A N/A N/A N/A
Mercaptopurine SPIKE_SARS2 Spike glycoprotein -4.26 N/A N/A N/A N/A
melatonin SPIKE_SARS2 Spike glycoprotein -5.35 N/A N/A N/A N/A