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 |