Ligand | Protein Symbol | Approved Name | Docking Scores |
Similarity Score |
Best Match | ||
---|---|---|---|---|---|---|---|
Model 1 | Model 2 | Model 3 | |||||
Glecaprevir | GP160_HIV1 | Envelope glycoprotein gp160 | -8.20 | -8.16 | -7.86 | N/A | N/A |
Pibrentasvir | GP160_HIV1 | Envelope glycoprotein gp160 | -7.61 | -8.01 | -7.83 | N/A | N/A |
Raltegravir | GP160_HIV1 | Envelope glycoprotein gp160 | -8.01 | -8.09 | -7.94 | N/A | N/A |
Doravirine | GP160_HIV1 | Envelope glycoprotein gp160 | -6.59 | -6.51 | -6.50 | N/A | N/A |
Fosamprenavir | GP160_HIV1 | Envelope glycoprotein gp160 | -6.58 | -5.79 | -6.64 | N/A | N/A |
Glecaprevir | GP160_HIV2 | Envelope glycoprotein gp160 | -8.66 | N/A | N/A | N/A | N/A |
Pibrentasvir | GP160_HIV2 | Envelope glycoprotein gp160 | -8.78 | N/A | N/A | N/A | N/A |
Raltegravir | GP160_HIV2 | Envelope glycoprotein gp160 | -8.09 | N/A | N/A | N/A | N/A |
Doravirine | GP160_HIV2 | Envelope glycoprotein gp160 | -7.42 | N/A | N/A | N/A | N/A |
Fosamprenavir | GP160_HIV2 | Envelope glycoprotein gp160 | -6.78 | N/A | N/A | N/A | N/A |
Glecaprevir | GP_EBOV | Envelope glycoprotein | -9.69 | -9.20 | -9.21 | 36.10% | CHEMBL3125899 |
Pibrentasvir | GP_EBOV | Envelope glycoprotein | -8.08 | -7.66 | -8.45 | 36.62% | CHEMBL3125895 |
Raltegravir | GP_EBOV | Envelope glycoprotein | -8.79 | -8.84 | -7.98 | 24.40% | CHEMBL3125895 |
Doravirine | GP_EBOV | Envelope glycoprotein | -8.01 | -8.44 | -8.08 | 21.07% | CHEMBL3125895 |
Fosamprenavir | GP_EBOV | Envelope glycoprotein | -7.59 | -6.93 | -7.05 | 27.81% | CHEMBL3125895 |
Glecaprevir | HA_A-H10N7 | Hemagglutinin | -8.00 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H10N7 | Hemagglutinin | -7.88 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H10N7 | Hemagglutinin | -7.97 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H10N7 | Hemagglutinin | -7.66 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H10N7 | Hemagglutinin | -6.55 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H10N8 | Hemagglutinin | -8.53 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H10N8 | Hemagglutinin | -7.43 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H10N8 | Hemagglutinin | -7.16 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H10N8 | Hemagglutinin | -7.09 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H10N8 | Hemagglutinin | -7.13 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H13N6 | Hemagglutinin | -7.33 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H13N6 | Hemagglutinin | 1.33 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H13N6 | Hemagglutinin | -7.57 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H13N6 | Hemagglutinin | 2.18 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H13N6 | Hemagglutinin | 5.80 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H14N6 | Hemagglutinin | -7.62 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H14N6 | Hemagglutinin | -7.45 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H14N6 | Hemagglutinin | -8.46 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H14N6 | Hemagglutinin | -7.33 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H14N6 | Hemagglutinin | -6.10 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H15N9 | Hemagglutinin | -8.12 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H15N9 | Hemagglutinin | -7.12 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H15N9 | Hemagglutinin | -7.39 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H15N9 | Hemagglutinin | -7.01 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H15N9 | Hemagglutinin | -6.40 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H17N10 | Hemagglutinin | -8.15 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H17N10 | Hemagglutinin | -8.34 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H17N10 | Hemagglutinin | -6.75 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H17N10 | Hemagglutinin | -6.64 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H17N10 | Hemagglutinin | -5.81 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H18N11 | Hemagglutinin | -7.54 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H18N11 | Hemagglutinin | -7.47 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H18N11 | Hemagglutinin | -6.99 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H18N11 | Hemagglutinin | -6.78 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H18N11 | Hemagglutinin | -5.66 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H1N1 | Hemagglutinin | -7.86 | -7.76 | N/A | N/A | N/A |
Pibrentasvir | HA_A-H1N1 | Hemagglutinin | -7.94 | -7.65 | N/A | N/A | N/A |
Raltegravir | HA_A-H1N1 | Hemagglutinin | -8.05 | -7.44 | N/A | N/A | N/A |
Doravirine | HA_A-H1N1 | Hemagglutinin | -7.34 | -7.66 | N/A | N/A | N/A |
Fosamprenavir | HA_A-H1N1 | Hemagglutinin | -6.89 | -6.23 | N/A | N/A | N/A |
Glecaprevir | HA_A-H2N2 | Hemagglutinin | -7.89 | -8.37 | N/A | N/A | N/A |
Pibrentasvir | HA_A-H2N2 | Hemagglutinin | -8.44 | -7.91 | N/A | N/A | N/A |
Raltegravir | HA_A-H2N2 | Hemagglutinin | -7.69 | -6.42 | N/A | N/A | N/A |
Doravirine | HA_A-H2N2 | Hemagglutinin | -7.28 | -7.14 | N/A | N/A | N/A |
Fosamprenavir | HA_A-H2N2 | Hemagglutinin | -5.38 | -5.57 | N/A | N/A | N/A |
Glecaprevir | HA_A-H3N2 | Hemagglutinin | -7.92 | -7.67 | -7.97 | N/A | N/A |
Pibrentasvir | HA_A-H3N2 | Hemagglutinin | -8.46 | -7.67 | -7.34 | N/A | N/A |
Raltegravir | HA_A-H3N2 | Hemagglutinin | -7.63 | -7.24 | -7.07 | N/A | N/A |
Doravirine | HA_A-H3N2 | Hemagglutinin | -6.79 | -6.69 | -6.78 | N/A | N/A |
Fosamprenavir | HA_A-H3N2 | Hemagglutinin | -7.00 | -6.36 | -6.72 | N/A | N/A |
Glecaprevir | HA_A-H3N8 | Hemagglutinin | -8.61 | -7.62 | -7.51 | N/A | N/A |
Pibrentasvir | HA_A-H3N8 | Hemagglutinin | -7.33 | -8.42 | -8.06 | N/A | N/A |
Raltegravir | HA_A-H3N8 | Hemagglutinin | -6.54 | -7.85 | -7.32 | N/A | N/A |
Doravirine | HA_A-H3N8 | Hemagglutinin | -6.66 | -7.14 | -6.72 | N/A | N/A |
Fosamprenavir | HA_A-H3N8 | Hemagglutinin | -6.05 | -5.61 | -5.23 | N/A | N/A |
Glecaprevir | HA_A-H5N1 | Hemagglutinin | -8.79 | -7.30 | -7.08 | N/A | N/A |
Pibrentasvir | HA_A-H5N1 | Hemagglutinin | -7.37 | -7.04 | -7.41 | N/A | N/A |
Raltegravir | HA_A-H5N1 | Hemagglutinin | -8.01 | -8.49 | -7.78 | N/A | N/A |
Doravirine | HA_A-H5N1 | Hemagglutinin | -6.75 | -8.11 | -7.70 | N/A | N/A |
Fosamprenavir | HA_A-H5N1 | Hemagglutinin | -6.74 | -5.49 | -6.08 | N/A | N/A |
Glecaprevir | HA_A-H5N3 | Hemagglutinin | -7.54 | -7.23 | N/A | N/A | N/A |
Pibrentasvir | HA_A-H5N3 | Hemagglutinin | -7.44 | -7.34 | N/A | N/A | N/A |
Raltegravir | HA_A-H5N3 | Hemagglutinin | -7.26 | -7.41 | N/A | N/A | N/A |
Doravirine | HA_A-H5N3 | Hemagglutinin | -7.50 | -6.85 | N/A | N/A | N/A |
Fosamprenavir | HA_A-H5N3 | Hemagglutinin | -6.19 | -5.97 | N/A | N/A | N/A |
Glecaprevir | HA_A-H6N1 | Hemagglutinin | -8.53 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H6N1 | Hemagglutinin | -7.43 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H6N1 | Hemagglutinin | -7.16 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H6N1 | Hemagglutinin | -7.09 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H6N1 | Hemagglutinin | -7.13 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H6N6 | Hemagglutinin | -8.37 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H6N6 | Hemagglutinin | -7.76 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H6N6 | Hemagglutinin | -7.19 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H6N6 | Hemagglutinin | -6.68 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H6N6 | Hemagglutinin | -6.33 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_A-H7N2 | Hemagglutinin | -8.66 | -7.40 | -8.00 | N/A | N/A |
Pibrentasvir | HA_A-H7N2 | Hemagglutinin | -7.84 | -8.12 | -6.59 | N/A | N/A |
Raltegravir | HA_A-H7N2 | Hemagglutinin | -7.12 | -7.20 | -6.85 | N/A | N/A |
Doravirine | HA_A-H7N2 | Hemagglutinin | -7.33 | -6.57 | -7.39 | N/A | N/A |
Fosamprenavir | HA_A-H7N2 | Hemagglutinin | -6.14 | -5.83 | -5.70 | N/A | N/A |
Glecaprevir | HA_A-H7N7 | Hemagglutinin | -7.41 | -8.74 | N/A | N/A | N/A |
Pibrentasvir | HA_A-H7N7 | Hemagglutinin | -6.96 | -7.41 | N/A | N/A | N/A |
Raltegravir | HA_A-H7N7 | Hemagglutinin | -6.86 | -7.49 | N/A | N/A | N/A |
Doravirine | HA_A-H7N7 | Hemagglutinin | -7.11 | -7.27 | N/A | N/A | N/A |
Fosamprenavir | HA_A-H7N7 | Hemagglutinin | -5.59 | -6.69 | N/A | N/A | N/A |
Glecaprevir | HA_A-H7N9 | Hemagglutinin | -8.49 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_A-H7N9 | Hemagglutinin | -7.90 | N/A | N/A | N/A | N/A |
Raltegravir | HA_A-H7N9 | Hemagglutinin | -7.39 | N/A | N/A | N/A | N/A |
Doravirine | HA_A-H7N9 | Hemagglutinin | -7.13 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_A-H7N9 | Hemagglutinin | -6.46 | N/A | N/A | N/A | N/A |
Glecaprevir | HA_INFB | Hemagglutinin | -8.86 | -8.45 | N/A | N/A | N/A |
Pibrentasvir | HA_INFB | Hemagglutinin | -7.55 | -7.00 | N/A | N/A | N/A |
Raltegravir | HA_INFB | Hemagglutinin | -7.72 | -7.10 | N/A | N/A | N/A |
Doravirine | HA_INFB | Hemagglutinin | -7.05 | -7.07 | N/A | N/A | N/A |
Fosamprenavir | HA_INFB | Hemagglutinin | -6.69 | -6.30 | N/A | N/A | N/A |
Glecaprevir | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -7.07 | N/A | N/A | N/A | N/A |
Pibrentasvir | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | 17.73 | N/A | N/A | N/A | N/A |
Raltegravir | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -5.39 | N/A | N/A | N/A | N/A |
Doravirine | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -5.02 | N/A | N/A | N/A | N/A |
Fosamprenavir | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | 2.27 | N/A | N/A | N/A | N/A |
Glecaprevir | HE_BCV | Hemagglutinin-esterase | -8.61 | -8.59 | N/A | N/A | N/A |
Pibrentasvir | HE_BCV | Hemagglutinin-esterase | -7.25 | -7.90 | N/A | N/A | N/A |
Raltegravir | HE_BCV | Hemagglutinin-esterase | -7.33 | -6.89 | N/A | N/A | N/A |
Doravirine | HE_BCV | Hemagglutinin-esterase | -6.47 | -6.51 | N/A | N/A | N/A |
Fosamprenavir | HE_BCV | Hemagglutinin-esterase | -6.65 | -6.63 | N/A | N/A | N/A |
Glecaprevir | HE_HCoV-OC43 | Hemagglutinin-esterase | -7.18 | N/A | N/A | N/A | N/A |
Pibrentasvir | HE_HCoV-OC43 | Hemagglutinin-esterase | -7.30 | N/A | N/A | N/A | N/A |
Raltegravir | HE_HCoV-OC43 | Hemagglutinin-esterase | -6.59 | N/A | N/A | N/A | N/A |
Doravirine | HE_HCoV-OC43 | Hemagglutinin-esterase | -6.91 | N/A | N/A | N/A | N/A |
Fosamprenavir | HE_HCoV-OC43 | Hemagglutinin-esterase | -5.22 | N/A | N/A | N/A | N/A |
Glecaprevir | HE_MHV | Hemagglutinin-esterase | -8.33 | N/A | N/A | N/A | N/A |
Pibrentasvir | HE_MHV | Hemagglutinin-esterase | -8.14 | N/A | N/A | N/A | N/A |
Raltegravir | HE_MHV | Hemagglutinin-esterase | -7.05 | N/A | N/A | N/A | N/A |
Doravirine | HE_MHV | Hemagglutinin-esterase | -6.92 | N/A | N/A | N/A | N/A |
Fosamprenavir | HE_MHV | Hemagglutinin-esterase | -5.35 | N/A | N/A | N/A | N/A |
Glecaprevir | IN_HIV1 | Gag-Pol polyprotein | -7.05 | -7.25 | N/A | N/A | N/A |
Pibrentasvir | IN_HIV1 | Gag-Pol polyprotein | -7.11 | -7.30 | N/A | N/A | N/A |
Raltegravir | IN_HIV1 | Gag-Pol polyprotein | -6.10 | -6.13 | N/A | N/A | N/A |
Doravirine | IN_HIV1 | Gag-Pol polyprotein | -5.86 | -6.09 | N/A | N/A | N/A |
Fosamprenavir | IN_HIV1 | Gag-Pol polyprotein | -5.61 | -4.72 | N/A | N/A | N/A |
Glecaprevir | MD_HKU4 | Replicase polyprotein 1ab | -9.58 | -8.79 | -10.47 | N/A | N/A |
Pibrentasvir | MD_HKU4 | Replicase polyprotein 1ab | -8.13 | -8.03 | -7.89 | N/A | N/A |
Raltegravir | MD_HKU4 | Replicase polyprotein 1ab | -9.09 | -9.25 | -8.99 | N/A | N/A |
Doravirine | MD_HKU4 | Replicase polyprotein 1ab | -8.19 | -8.16 | -7.99 | N/A | N/A |
Fosamprenavir | MD_HKU4 | Replicase polyprotein 1ab | -8.10 | -7.62 | -8.02 | N/A | N/A |
Glecaprevir | MD_MERs | Replicase polyprotein 1a | -10.19 | -11.08 | N/A | N/A | N/A |
Pibrentasvir | MD_MERs | Replicase polyprotein 1a | -8.04 | -8.72 | N/A | N/A | N/A |
Raltegravir | MD_MERs | Replicase polyprotein 1a | -9.69 | -9.17 | N/A | N/A | N/A |
Doravirine | MD_MERs | Replicase polyprotein 1a | -8.17 | -8.63 | N/A | N/A | N/A |
Fosamprenavir | MD_MERs | Replicase polyprotein 1a | -8.31 | -8.33 | N/A | N/A | N/A |
Glecaprevir | MX2_A-H5N1 | Matrix protein 2 | 59.02 | N/A | N/A | N/A | N/A |
Pibrentasvir | MX2_A-H5N1 | Matrix protein 2 | ? | N/A | N/A | N/A | N/A |
Raltegravir | MX2_A-H5N1 | Matrix protein 2 | -3.37 | N/A | N/A | N/A | N/A |
Doravirine | MX2_A-H5N1 | Matrix protein 2 | -6.12 | N/A | N/A | N/A | N/A |
Fosamprenavir | MX2_A-H5N1 | Matrix protein 2 | -4.88 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H11N6 | Neuraminidase | -10.05 | -9.81 | -10.77 | N/A | N/A |
Pibrentasvir | NA_A-H11N6 | Neuraminidase | -7.68 | -4.94 | -4.03 | N/A | N/A |
Raltegravir | NA_A-H11N6 | Neuraminidase | -8.80 | -8.85 | -8.24 | N/A | N/A |
Doravirine | NA_A-H11N6 | Neuraminidase | -8.13 | -8.28 | -7.76 | N/A | N/A |
Fosamprenavir | NA_A-H11N6 | Neuraminidase | -7.55 | -7.45 | -7.85 | N/A | N/A |
Glecaprevir | NA_A-H11N9 | Neuraminidase | -7.20 | -10.26 | -10.15 | N/A | N/A |
Pibrentasvir | NA_A-H11N9 | Neuraminidase | -7.37 | -8.20 | -7.71 | N/A | N/A |
Raltegravir | NA_A-H11N9 | Neuraminidase | -7.89 | -8.98 | -9.40 | N/A | N/A |
Doravirine | NA_A-H11N9 | Neuraminidase | -7.63 | -8.06 | -8.40 | N/A | N/A |
Fosamprenavir | NA_A-H11N9 | Neuraminidase | -7.11 | -7.55 | -8.04 | N/A | N/A |
Glecaprevir | NA_A-H12N5 | Neuraminidase | -9.24 | -8.37 | -9.01 | N/A | N/A |
Pibrentasvir | NA_A-H12N5 | Neuraminidase | -2.03 | -0.29 | -7.24 | N/A | N/A |
Raltegravir | NA_A-H12N5 | Neuraminidase | -9.12 | -9.20 | -9.23 | N/A | N/A |
Doravirine | NA_A-H12N5 | Neuraminidase | -8.32 | -7.99 | -7.78 | N/A | N/A |
Fosamprenavir | NA_A-H12N5 | Neuraminidase | -7.39 | -8.03 | -7.64 | N/A | N/A |
Glecaprevir | NA_A-H13N9 | Neuraminidase | -7.62 | N/A | N/A | N/A | N/A |
Pibrentasvir | NA_A-H13N9 | Neuraminidase | -7.61 | N/A | N/A | N/A | N/A |
Raltegravir | NA_A-H13N9 | Neuraminidase | -8.69 | N/A | N/A | N/A | N/A |
Doravirine | NA_A-H13N9 | Neuraminidase | -6.66 | N/A | N/A | N/A | N/A |
Fosamprenavir | NA_A-H13N9 | Neuraminidase | -5.70 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H17N10 | Neuraminidase | -8.78 | N/A | N/A | N/A | N/A |
Pibrentasvir | NA_A-H17N10 | Neuraminidase | -6.96 | N/A | N/A | N/A | N/A |
Raltegravir | NA_A-H17N10 | Neuraminidase | -8.24 | N/A | N/A | N/A | N/A |
Doravirine | NA_A-H17N10 | Neuraminidase | -8.05 | N/A | N/A | N/A | N/A |
Fosamprenavir | NA_A-H17N10 | Neuraminidase | -7.01 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H18N11 | Neuraminidase | -9.31 | N/A | N/A | N/A | N/A |
Pibrentasvir | NA_A-H18N11 | Neuraminidase | -8.54 | N/A | N/A | N/A | N/A |
Raltegravir | NA_A-H18N11 | Neuraminidase | -7.40 | N/A | N/A | N/A | N/A |
Doravirine | NA_A-H18N11 | Neuraminidase | -6.98 | N/A | N/A | N/A | N/A |
Fosamprenavir | NA_A-H18N11 | Neuraminidase | -6.41 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H1N1 | Neuraminidase | -10.60 | N/A | N/A | N/A | N/A |
Pibrentasvir | NA_A-H1N1 | Neuraminidase | -9.14 | N/A | N/A | N/A | N/A |
Raltegravir | NA_A-H1N1 | Neuraminidase | -9.50 | N/A | N/A | N/A | N/A |
Doravirine | NA_A-H1N1 | Neuraminidase | -8.02 | N/A | N/A | N/A | N/A |
Fosamprenavir | NA_A-H1N1 | Neuraminidase | -7.56 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H2N2 | Neuraminidase | -10.78 | -11.72 | -11.10 | N/A | N/A |
Pibrentasvir | NA_A-H2N2 | Neuraminidase | -7.89 | -8.66 | -9.28 | N/A | N/A |
Raltegravir | NA_A-H2N2 | Neuraminidase | -8.56 | -9.18 | -8.60 | N/A | N/A |
Doravirine | NA_A-H2N2 | Neuraminidase | -8.16 | -8.05 | -7.60 | N/A | N/A |
Fosamprenavir | NA_A-H2N2 | Neuraminidase | -7.34 | -7.82 | -7.14 | N/A | N/A |
Glecaprevir | NA_A-H3N2 | Ig heavy chain Mem5 | -10.57 | -8.96 | N/A | N/A | N/A |
Pibrentasvir | NA_A-H3N2 | Ig heavy chain Mem5 | -8.65 | -8.27 | N/A | N/A | N/A |
Raltegravir | NA_A-H3N2 | Ig heavy chain Mem5 | -8.76 | -8.80 | N/A | N/A | N/A |
Doravirine | NA_A-H3N2 | Ig heavy chain Mem5 | -7.66 | -7.35 | N/A | N/A | N/A |
Fosamprenavir | NA_A-H3N2 | Ig heavy chain Mem5 | -6.62 | -6.67 | N/A | N/A | N/A |
Glecaprevir | NA_A-H3N8 | Neuraminidase | -10.43 | -10.53 | -9.55 | N/A | N/A |
Pibrentasvir | NA_A-H3N8 | Neuraminidase | -8.14 | -8.62 | -1.94 | N/A | N/A |
Raltegravir | NA_A-H3N8 | Neuraminidase | -8.37 | -9.13 | -8.46 | N/A | N/A |
Doravirine | NA_A-H3N8 | Neuraminidase | -7.55 | -8.03 | -8.45 | N/A | N/A |
Fosamprenavir | NA_A-H3N8 | Neuraminidase | -7.90 | -8.78 | -7.77 | N/A | N/A |
Glecaprevir | NA_A-H5N1 | Neuraminidase | -9.75 | N/A | N/A | N/A | N/A |
Pibrentasvir | NA_A-H5N1 | Neuraminidase | -7.82 | N/A | N/A | N/A | N/A |
Raltegravir | NA_A-H5N1 | Neuraminidase | -9.17 | N/A | N/A | N/A | N/A |
Doravirine | NA_A-H5N1 | Neuraminidase | -8.41 | N/A | N/A | N/A | N/A |
Fosamprenavir | NA_A-H5N1 | Neuraminidase | -7.98 | N/A | N/A | N/A | N/A |
Glecaprevir | NA_A-H7N9 | Neuraminidase | -9.86 | -10.31 | -9.97 | N/A | N/A |
Pibrentasvir | NA_A-H7N9 | Neuraminidase | -9.05 | -6.93 | -8.02 | N/A | N/A |
Raltegravir | NA_A-H7N9 | Neuraminidase | -9.54 | -10.29 | -9.68 | N/A | N/A |
Doravirine | NA_A-H7N9 | Neuraminidase | -8.16 | -8.18 | -7.99 | N/A | N/A |
Fosamprenavir | NA_A-H7N9 | Neuraminidase | -7.81 | -7.71 | -7.54 | N/A | N/A |
Glecaprevir | NA_INFB | Neuraminidase | -9.75 | -9.47 | N/A | 32.19% | CHEMBL4175983 |
Pibrentasvir | NA_INFB | Neuraminidase | -7.10 | -8.35 | N/A | 33.58% | CHEMBL4175983 |
Raltegravir | NA_INFB | Neuraminidase | -8.18 | -8.78 | N/A | 23.47% | CHEMBL4175983 |
Doravirine | NA_INFB | Neuraminidase | -8.08 | -7.89 | N/A | 21.24% | CHEMBL4175983 |
Fosamprenavir | NA_INFB | Neuraminidase | -7.46 | -7.54 | N/A | 26.72% | CHEMBL79499 |
Glecaprevir | NP_A-H1N1 | Nucleoprotein | -8.12 | -7.35 | -7.38 | N/A | N/A |
Pibrentasvir | NP_A-H1N1 | Nucleoprotein | -6.78 | -6.75 | -8.08 | N/A | N/A |
Raltegravir | NP_A-H1N1 | Nucleoprotein | -6.99 | -8.07 | -7.52 | N/A | N/A |
Doravirine | NP_A-H1N1 | Nucleoprotein | -7.66 | -7.18 | -6.61 | N/A | N/A |
Fosamprenavir | NP_A-H1N1 | Nucleoprotein | -5.92 | -7.78 | -6.68 | N/A | N/A |
Glecaprevir | NP_A-H5N1 | Nucleoprotein | -7.73 | N/A | N/A | N/A | N/A |
Pibrentasvir | NP_A-H5N1 | Nucleoprotein | -7.82 | N/A | N/A | N/A | N/A |
Raltegravir | NP_A-H5N1 | Nucleoprotein | -7.54 | N/A | N/A | N/A | N/A |
Doravirine | NP_A-H5N1 | Nucleoprotein | -6.88 | N/A | N/A | N/A | N/A |
Fosamprenavir | NP_A-H5N1 | Nucleoprotein | -5.96 | N/A | N/A | N/A | N/A |
Glecaprevir | NP_HCoV-NL63 | Nucleoprotein | -8.62 | N/A | N/A | N/A | N/A |
Pibrentasvir | NP_HCoV-NL63 | Nucleoprotein | -7.81 | N/A | N/A | N/A | N/A |
Raltegravir | NP_HCoV-NL63 | Nucleoprotein | -7.65 | N/A | N/A | N/A | N/A |
Doravirine | NP_HCoV-NL63 | Nucleoprotein | -7.58 | N/A | N/A | N/A | N/A |
Fosamprenavir | NP_HCoV-NL63 | Nucleoprotein | -6.14 | N/A | N/A | N/A | N/A |
Glecaprevir | NP_HCoV-OC43 | Nucleoprotein | -9.51 | -8.94 | -8.56 | 13.04% | CHEMBL3233481 |
Pibrentasvir | NP_HCoV-OC43 | Nucleoprotein | -8.62 | -7.77 | -7.87 | 19.74% | CHEMBL3233481 |
Raltegravir | NP_HCoV-OC43 | Nucleoprotein | -9.47 | -8.46 | -7.96 | 15.77% | CHEMBL3233481 |
Doravirine | NP_HCoV-OC43 | Nucleoprotein | -8.87 | -8.50 | -8.17 | 18.65% | CHEMBL3233481 |
Fosamprenavir | NP_HCoV-OC43 | Nucleoprotein | -7.45 | -7.31 | -6.89 | 12.20% | CHEMBL3233481 |
Glecaprevir | NP_INFB | Nucleoprotein | -7.04 | N/A | N/A | N/A | N/A |
Pibrentasvir | NP_INFB | Nucleoprotein | -7.74 | N/A | N/A | N/A | N/A |
Raltegravir | NP_INFB | Nucleoprotein | -6.27 | N/A | N/A | N/A | N/A |
Doravirine | NP_INFB | Nucleoprotein | -6.38 | N/A | N/A | N/A | N/A |
Fosamprenavir | NP_INFB | Nucleoprotein | -5.64 | N/A | N/A | N/A | N/A |
Glecaprevir | NP_INFD | NP | -6.42 | N/A | N/A | N/A | N/A |
Pibrentasvir | NP_INFD | NP | -6.34 | N/A | N/A | N/A | N/A |
Raltegravir | NP_INFD | NP | -6.53 | N/A | N/A | N/A | N/A |
Doravirine | NP_INFD | NP | -5.50 | N/A | N/A | N/A | N/A |
Fosamprenavir | NP_INFD | NP | -4.86 | N/A | N/A | N/A | N/A |
Glecaprevir | NP_SARS | Nucleoprotein | -8.79 | N/A | N/A | N/A | N/A |
Pibrentasvir | NP_SARS | Nucleoprotein | -8.05 | N/A | N/A | N/A | N/A |
Raltegravir | NP_SARS | Nucleoprotein | -7.72 | N/A | N/A | N/A | N/A |
Doravirine | NP_SARS | Nucleoprotein | -8.18 | N/A | N/A | N/A | N/A |
Fosamprenavir | NP_SARS | Nucleoprotein | -7.34 | N/A | N/A | N/A | N/A |
Glecaprevir | NS3_HCV1A | Genome polyprotein | -9.40 | -7.97 | -7.93 | 37.18% | CHEMBL3921348 |
Pibrentasvir | NS3_HCV1A | Genome polyprotein | -8.09 | -8.11 | -9.13 | 45.70% | CHEMBL3983555 |
Raltegravir | NS3_HCV1A | Genome polyprotein | -9.08 | -7.03 | -7.94 | 33.87% | CHEMBL3914349 |
Doravirine | NS3_HCV1A | Genome polyprotein | -8.49 | -6.10 | -7.40 | 29.78% | CHEMBL3948327 |
Fosamprenavir | NS3_HCV1A | Genome polyprotein | -5.79 | -5.78 | -6.38 | 28.47% | CHEMBL3696817 |
Glecaprevir | NS3_HCV1B | Genome polyprotein | -9.13 | -8.31 | -7.47 | 42.13% | CHEMBL297884 |
Pibrentasvir | NS3_HCV1B | Genome polyprotein | -8.48 | -8.24 | -8.27 | 36.06% | CHEMBL3954962 |
Raltegravir | NS3_HCV1B | Genome polyprotein | -8.45 | -8.30 | -7.16 | 29.74% | CHEMBL3125634 |
Doravirine | NS3_HCV1B | Genome polyprotein | -7.70 | -7.50 | -6.06 | 26.73% | CHEMBL1170417 |
Fosamprenavir | NS3_HCV1B | Genome polyprotein | -7.21 | -5.68 | -6.26 | 37.01% | CHEMBL1170417 |
Glecaprevir | NS3_HCV3A | Genome polyprotein | -9.72 | -9.30 | -9.49 | N/A | N/A |
Pibrentasvir | NS3_HCV3A | Genome polyprotein | -7.93 | -9.05 | -8.58 | N/A | N/A |
Raltegravir | NS3_HCV3A | Genome polyprotein | -8.34 | -7.99 | -7.60 | N/A | N/A |
Doravirine | NS3_HCV3A | Genome polyprotein | -6.86 | -7.28 | -7.33 | N/A | N/A |
Fosamprenavir | NS3_HCV3A | Genome polyprotein | -6.38 | -6.74 | -6.68 | N/A | N/A |
Glecaprevir | NS5B_HCV1A | Genome polyprotein | -11.01 | -11.84 | -12.06 | 41.83% | CHEMBL3644875 |
Pibrentasvir | NS5B_HCV1A | Genome polyprotein | -11.21 | -9.28 | -9.44 | 43.59% | CHEMBL353549 |
Raltegravir | NS5B_HCV1A | Genome polyprotein | -9.10 | -10.38 | -10.13 | 32.39% | CHEMBL353549 |
Doravirine | NS5B_HCV1A | Genome polyprotein | -7.90 | -8.61 | -8.27 | 27.14% | CHEMBL176058 |
Fosamprenavir | NS5B_HCV1A | Genome polyprotein | -7.73 | -8.03 | -8.33 | 41.15% | CHEMBL3644924 |
Glecaprevir | NS5B_HCV1B | Genome polyprotein | -10.64 | -7.78 | -8.20 | 30.59% | CHEMBL3645214 |
Pibrentasvir | NS5B_HCV1B | Genome polyprotein | -8.78 | -8.41 | -8.21 | 41.61% | CHEMBL3645205 |
Raltegravir | NS5B_HCV1B | Genome polyprotein | -8.39 | -8.38 | -8.04 | 33.33% | CHEMBL3645179 |
Doravirine | NS5B_HCV1B | Genome polyprotein | -9.22 | -7.71 | -7.81 | 30.51% | CHEMBL3645208 |
Fosamprenavir | NS5B_HCV1B | Genome polyprotein | -8.11 | -8.42 | -7.75 | 34.19% | CHEMBL3645210 |
Glecaprevir | NS5B_HCV2A | Genome polyprotein | -9.32 | -5.37 | N/A | N/A | N/A |
Pibrentasvir | NS5B_HCV2A | Genome polyprotein | -8.82 | 36.13 | N/A | N/A | N/A |
Raltegravir | NS5B_HCV2A | Genome polyprotein | -10.38 | -9.90 | N/A | N/A | N/A |
Doravirine | NS5B_HCV2A | Genome polyprotein | -9.39 | -8.96 | N/A | N/A | N/A |
Fosamprenavir | NS5B_HCV2A | Genome polyprotein | -8.51 | -8.26 | N/A | N/A | N/A |
Glecaprevir | NSP15_SARS | Replicase polyprotein 1ab | 23.09 | N/A | N/A | 26.52% | CHEMBL2441745 |
Pibrentasvir | NSP15_SARS | Replicase polyprotein 1ab | ? | N/A | N/A | ? | ? |
Raltegravir | NSP15_SARS | Replicase polyprotein 1ab | -7.08 | N/A | N/A | 21.62% | CHEMBL2441745 |
Doravirine | NSP15_SARS | Replicase polyprotein 1ab | -6.92 | N/A | N/A | 21.40% | CHEMBL221366 |
Fosamprenavir | NSP15_SARS | Replicase polyprotein 1ab | -6.56 | N/A | N/A | 34.58% | CHEMBL2441745 |
Glecaprevir | NSP1_INFB | Non-structural protein 1 | -8.06 | -8.06 | N/A | N/A | N/A |
Pibrentasvir | NSP1_INFB | Non-structural protein 1 | -7.84 | -7.66 | N/A | N/A | N/A |
Raltegravir | NSP1_INFB | Non-structural protein 1 | -6.87 | -6.61 | N/A | N/A | N/A |
Doravirine | NSP1_INFB | Non-structural protein 1 | -6.93 | -6.75 | N/A | N/A | N/A |
Fosamprenavir | NSP1_INFB | Non-structural protein 1 | -5.54 | -5.84 | N/A | N/A | N/A |
Glecaprevir | NSP1_SARS | Replicase polyprotein 1ab | -5.64 | N/A | N/A | 26.52% | CHEMBL2441745 |
Pibrentasvir | NSP1_SARS | Replicase polyprotein 1ab | -5.71 | N/A | N/A | 35.86% | CHEMBL2441741 |
Raltegravir | NSP1_SARS | Replicase polyprotein 1ab | -7.14 | N/A | N/A | 21.62% | CHEMBL2441745 |
Doravirine | NSP1_SARS | Replicase polyprotein 1ab | -6.32 | N/A | N/A | 21.40% | CHEMBL221366 |
Fosamprenavir | NSP1_SARS | Replicase polyprotein 1ab | -5.33 | N/A | N/A | 34.58% | CHEMBL2441745 |
Glecaprevir | NSP3_HCoV-229E | Replicase polyprotein 1a | -9.78 | N/A | N/A | N/A | N/A |
Pibrentasvir | NSP3_HCoV-229E | Replicase polyprotein 1a | -8.44 | N/A | N/A | N/A | N/A |
Raltegravir | NSP3_HCoV-229E | Replicase polyprotein 1a | -10.09 | N/A | N/A | N/A | N/A |
Doravirine | NSP3_HCoV-229E | Replicase polyprotein 1a | -9.70 | N/A | N/A | N/A | N/A |
Fosamprenavir | NSP3_HCoV-229E | Replicase polyprotein 1a | -8.24 | N/A | N/A | N/A | N/A |
Glecaprevir | NSP3_IBV | Replicase polyprotein 1a | -9.74 | N/A | N/A | N/A | N/A |
Pibrentasvir | NSP3_IBV | Replicase polyprotein 1a | -8.83 | N/A | N/A | N/A | N/A |
Raltegravir | NSP3_IBV | Replicase polyprotein 1a | -9.67 | N/A | N/A | N/A | N/A |
Doravirine | NSP3_IBV | Replicase polyprotein 1a | -8.86 | N/A | N/A | N/A | N/A |
Fosamprenavir | NSP3_IBV | Replicase polyprotein 1a | -7.84 | N/A | N/A | N/A | N/A |
Glecaprevir | NSP3_MHV | Replicase polyprotein 1ab | -6.74 | N/A | N/A | N/A | N/A |
Pibrentasvir | NSP3_MHV | Replicase polyprotein 1ab | ? | N/A | N/A | N/A | N/A |
Raltegravir | NSP3_MHV | Replicase polyprotein 1ab | -5.54 | N/A | N/A | N/A | N/A |
Doravirine | NSP3_MHV | Replicase polyprotein 1ab | -5.51 | N/A | N/A | N/A | N/A |
Fosamprenavir | NSP3_MHV | Replicase polyprotein 1ab | 4.17 | N/A | N/A | N/A | N/A |
Glecaprevir | NSP9_HCoV-229E | Replicase polyprotein 1ab | -8.12 | -5.44 | N/A | N/A | N/A |
Pibrentasvir | NSP9_HCoV-229E | Replicase polyprotein 1ab | 0.07 | -5.35 | N/A | N/A | N/A |
Raltegravir | NSP9_HCoV-229E | Replicase polyprotein 1ab | -7.41 | -7.37 | N/A | N/A | N/A |
Doravirine | NSP9_HCoV-229E | Replicase polyprotein 1ab | -7.03 | -7.05 | N/A | N/A | N/A |
Fosamprenavir | NSP9_HCoV-229E | Replicase polyprotein 1ab | -6.18 | -6.28 | N/A | N/A | N/A |
Glecaprevir | PA_A-H17N10 | Polymerase acidic protein | -9.72 | N/A | N/A | N/A | N/A |
Pibrentasvir | PA_A-H17N10 | Polymerase acidic protein | -8.46 | N/A | N/A | N/A | N/A |
Raltegravir | PA_A-H17N10 | Polymerase acidic protein | -8.86 | N/A | N/A | N/A | N/A |
Doravirine | PA_A-H17N10 | Polymerase acidic protein | -7.93 | N/A | N/A | N/A | N/A |
Fosamprenavir | PA_A-H17N10 | Polymerase acidic protein | -7.64 | N/A | N/A | N/A | N/A |
Glecaprevir | PA_A-H1N1 | Polymerase acidic protein | -10.01 | -9.54 | -10.79 | N/A | N/A |
Pibrentasvir | PA_A-H1N1 | Polymerase acidic protein | -9.38 | -8.68 | -11.01 | N/A | N/A |
Raltegravir | PA_A-H1N1 | Polymerase acidic protein | -9.06 | -8.58 | -9.79 | N/A | N/A |
Doravirine | PA_A-H1N1 | Polymerase acidic protein | -7.67 | -8.30 | -8.13 | N/A | N/A |
Fosamprenavir | PA_A-H1N1 | Polymerase acidic protein | -7.96 | -7.88 | -7.94 | N/A | N/A |
Glecaprevir | PA_A-H5N1 | Polymerase acidic protein | -10.88 | -10.28 | -10.59 | N/A | N/A |
Pibrentasvir | PA_A-H5N1 | Polymerase acidic protein | -9.03 | -8.52 | -8.97 | N/A | N/A |
Raltegravir | PA_A-H5N1 | Polymerase acidic protein | -9.27 | -9.42 | -9.27 | N/A | N/A |
Doravirine | PA_A-H5N1 | Polymerase acidic protein | -8.17 | -8.02 | -8.22 | N/A | N/A |
Fosamprenavir | PA_A-H5N1 | Polymerase acidic protein | -8.36 | -8.05 | -8.28 | N/A | N/A |
Glecaprevir | PA_INFA | Polymerase acidic protein | -9.65 | -10.53 | -10.34 | 25.00% | CHEMBL2040569 |
Pibrentasvir | PA_INFA | Polymerase acidic protein | -7.78 | -7.83 | -8.67 | 27.66% | CHEMBL2040578 |
Raltegravir | PA_INFA | Polymerase acidic protein | -10.14 | -7.71 | -9.15 | 49.57% | CHEMBL2040578 |
Doravirine | PA_INFA | Polymerase acidic protein | -9.22 | -7.81 | -7.92 | 27.31% | CHEMBL2443239 |
Fosamprenavir | PA_INFA | Polymerase acidic protein | -7.78 | -7.85 | -7.32 | 29.00% | CHEMBL2040640 |
Glecaprevir | PA_INFB | Polymerase acidic protein | -9.38 | N/A | N/A | N/A | N/A |
Pibrentasvir | PA_INFB | Polymerase acidic protein | -8.46 | N/A | N/A | N/A | N/A |
Raltegravir | PA_INFB | Polymerase acidic protein | -8.69 | N/A | N/A | N/A | N/A |
Doravirine | PA_INFB | Polymerase acidic protein | -8.08 | N/A | N/A | N/A | N/A |
Fosamprenavir | PA_INFB | Polymerase acidic protein | -8.13 | N/A | N/A | N/A | N/A |
Glecaprevir | PB2_A-H3N2 | Polymerase basic protein 2 | -9.29 | -8.68 | N/A | N/A | N/A |
Pibrentasvir | PB2_A-H3N2 | Polymerase basic protein 2 | -8.03 | -7.93 | N/A | N/A | N/A |
Raltegravir | PB2_A-H3N2 | Polymerase basic protein 2 | -8.25 | -8.72 | N/A | N/A | N/A |
Doravirine | PB2_A-H3N2 | Polymerase basic protein 2 | -8.22 | -8.20 | N/A | N/A | N/A |
Fosamprenavir | PB2_A-H3N2 | Polymerase basic protein 2 | -7.13 | -7.43 | N/A | N/A | N/A |
Glecaprevir | PB2_A-H5N1 | Polymerase basic protein 2 | -8.50 | -8.13 | -8.95 | N/A | N/A |
Pibrentasvir | PB2_A-H5N1 | Polymerase basic protein 2 | -8.28 | -7.81 | -8.32 | N/A | N/A |
Raltegravir | PB2_A-H5N1 | Polymerase basic protein 2 | -9.21 | -8.36 | -9.01 | N/A | N/A |
Doravirine | PB2_A-H5N1 | Polymerase basic protein 2 | -8.23 | -8.11 | -7.97 | N/A | N/A |
Fosamprenavir | PB2_A-H5N1 | Polymerase basic protein 2 | -7.02 | -6.62 | -7.12 | N/A | N/A |
Glecaprevir | PB2_INFB | Polymerase basic protein 2 | -9.06 | N/A | N/A | N/A | N/A |
Pibrentasvir | PB2_INFB | Polymerase basic protein 2 | -8.49 | N/A | N/A | N/A | N/A |
Raltegravir | PB2_INFB | Polymerase basic protein 2 | -8.91 | N/A | N/A | N/A | N/A |
Doravirine | PB2_INFB | Polymerase basic protein 2 | -9.40 | N/A | N/A | N/A | N/A |
Fosamprenavir | PB2_INFB | Polymerase basic protein 2 | -7.21 | N/A | N/A | N/A | N/A |
Glecaprevir | PB3_A-H3N2 | Polymerase basic protein 2 | -8.63 | N/A | N/A | N/A | N/A |
Pibrentasvir | PB3_A-H3N2 | Polymerase basic protein 2 | -7.68 | N/A | N/A | N/A | N/A |
Raltegravir | PB3_A-H3N2 | Polymerase basic protein 2 | -8.49 | N/A | N/A | N/A | N/A |
Doravirine | PB3_A-H3N2 | Polymerase basic protein 2 | -7.98 | N/A | N/A | N/A | N/A |
Fosamprenavir | PB3_A-H3N2 | Polymerase basic protein 2 | -7.15 | N/A | N/A | N/A | N/A |
Glecaprevir | PB4_A-H3N2 | Polymerase basic protein 2 | -9.19 | N/A | N/A | N/A | N/A |
Pibrentasvir | PB4_A-H3N2 | Polymerase basic protein 2 | -8.67 | N/A | N/A | N/A | N/A |
Raltegravir | PB4_A-H3N2 | Polymerase basic protein 2 | -8.60 | N/A | N/A | N/A | N/A |
Doravirine | PB4_A-H3N2 | Polymerase basic protein 2 | -8.58 | N/A | N/A | N/A | N/A |
Fosamprenavir | PB4_A-H3N2 | Polymerase basic protein 2 | -7.14 | N/A | N/A | N/A | N/A |
Glecaprevir | PLP_SARS | Replicase polyprotein 1a | -9.50 | -9.60 | -9.57 | 33.44% | CHEMBL212080 |
Pibrentasvir | PLP_SARS | Replicase polyprotein 1a | -8.17 | -7.99 | -7.93 | 38.56% | CHEMBL213054 |
Raltegravir | PLP_SARS | Replicase polyprotein 1a | -9.17 | -10.69 | -10.14 | 23.77% | CHEMBL358279 |
Doravirine | PLP_SARS | Replicase polyprotein 1a | -8.49 | -8.96 | -8.05 | 30.65% | CHEMBL222735 |
Fosamprenavir | PLP_SARS | Replicase polyprotein 1a | -8.16 | -8.27 | -8.27 | 27.93% | CHEMBL213054 |
Glecaprevir | PR_FCoV | Replicase polyprotein 1ab | -8.91 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_FCoV | Replicase polyprotein 1ab | -7.85 | N/A | N/A | N/A | N/A |
Raltegravir | PR_FCoV | Replicase polyprotein 1ab | -7.49 | N/A | N/A | N/A | N/A |
Doravirine | PR_FCoV | Replicase polyprotein 1ab | -8.23 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_FCoV | Replicase polyprotein 1ab | -7.59 | N/A | N/A | N/A | N/A |
Glecaprevir | PR_HCoV-229E | Replicase polyprotein 1a | -9.47 | -8.02 | N/A | N/A | N/A |
Pibrentasvir | PR_HCoV-229E | Replicase polyprotein 1a | -7.61 | -8.35 | N/A | N/A | N/A |
Raltegravir | PR_HCoV-229E | Replicase polyprotein 1a | -7.76 | -8.33 | N/A | N/A | N/A |
Doravirine | PR_HCoV-229E | Replicase polyprotein 1a | -8.51 | -7.99 | N/A | N/A | N/A |
Fosamprenavir | PR_HCoV-229E | Replicase polyprotein 1a | -7.32 | -7.15 | N/A | N/A | N/A |
Glecaprevir | PR_HCoV-NL63 | Replicase polyprotein 1a | -6.11 | -10.15 | N/A | N/A | N/A |
Pibrentasvir | PR_HCoV-NL63 | Replicase polyprotein 1a | -5.17 | -8.37 | N/A | N/A | N/A |
Raltegravir | PR_HCoV-NL63 | Replicase polyprotein 1a | -5.48 | -7.87 | N/A | N/A | N/A |
Doravirine | PR_HCoV-NL63 | Replicase polyprotein 1a | -4.89 | -7.85 | N/A | N/A | N/A |
Fosamprenavir | PR_HCoV-NL63 | Replicase polyprotein 1a | -4.68 | -7.93 | N/A | N/A | N/A |
Glecaprevir | PR_HIV1 | Gag-Pol polyprotein | -8.18 | -8.38 | -7.89 | 33.75% | CHEMBL494499 |
Pibrentasvir | PR_HIV1 | Gag-Pol polyprotein | -6.71 | -7.66 | -7.93 | 26.22% | CHEMBL450294 |
Raltegravir | PR_HIV1 | Gag-Pol polyprotein | -7.20 | -7.35 | -7.62 | 20.63% | CHEMBL3645129 |
Doravirine | PR_HIV1 | Gag-Pol polyprotein | -7.71 | -6.95 | -7.13 | 18.60% | CHEMBL492666 |
Fosamprenavir | PR_HIV1 | Gag-Pol polyprotein | -5.83 | -6.18 | -6.17 | 75.28% | CHEMBL510485 |
Glecaprevir | PR_HIV2 | Gag-Pol polyprotein | -8.91 | -8.23 | N/A | N/A | N/A |
Pibrentasvir | PR_HIV2 | Gag-Pol polyprotein | -9.17 | -7.85 | N/A | N/A | N/A |
Raltegravir | PR_HIV2 | Gag-Pol polyprotein | -7.97 | -7.37 | N/A | N/A | N/A |
Doravirine | PR_HIV2 | Gag-Pol polyprotein | -7.60 | -7.00 | N/A | N/A | N/A |
Fosamprenavir | PR_HIV2 | Gag-Pol polyprotein | -6.52 | -6.27 | N/A | N/A | N/A |
Glecaprevir | PR_HKU1 | Replicase polyprotein 1a | -7.01 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_HKU1 | Replicase polyprotein 1a | -7.45 | N/A | N/A | N/A | N/A |
Raltegravir | PR_HKU1 | Replicase polyprotein 1a | -8.48 | N/A | N/A | N/A | N/A |
Doravirine | PR_HKU1 | Replicase polyprotein 1a | -7.57 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_HKU1 | Replicase polyprotein 1a | -7.47 | N/A | N/A | N/A | N/A |
Glecaprevir | PR_HKU4 | Replicase polyprotein 1ab | -8.57 | -7.91 | -8.32 | N/A | N/A |
Pibrentasvir | PR_HKU4 | Replicase polyprotein 1ab | -8.76 | -8.00 | -9.09 | N/A | N/A |
Raltegravir | PR_HKU4 | Replicase polyprotein 1ab | -7.64 | -7.69 | -7.33 | N/A | N/A |
Doravirine | PR_HKU4 | Replicase polyprotein 1ab | -7.96 | -8.65 | -8.90 | N/A | N/A |
Fosamprenavir | PR_HKU4 | Replicase polyprotein 1ab | -7.52 | -7.07 | -7.50 | N/A | N/A |
Glecaprevir | PR_IBV | Replicase polyprotein 1a | -8.34 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_IBV | Replicase polyprotein 1a | -7.85 | N/A | N/A | N/A | N/A |
Raltegravir | PR_IBV | Replicase polyprotein 1a | -8.92 | N/A | N/A | N/A | N/A |
Doravirine | PR_IBV | Replicase polyprotein 1a | -8.39 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_IBV | Replicase polyprotein 1a | -7.42 | N/A | N/A | N/A | N/A |
Glecaprevir | PR_MERs | 3C-like proteinase | -8.74 | -8.29 | N/A | N/A | N/A |
Pibrentasvir | PR_MERs | 3C-like proteinase | -8.53 | -8.57 | N/A | N/A | N/A |
Raltegravir | PR_MERs | 3C-like proteinase | -7.60 | -8.31 | N/A | N/A | N/A |
Doravirine | PR_MERs | 3C-like proteinase | -8.43 | -7.98 | N/A | N/A | N/A |
Fosamprenavir | PR_MERs | 3C-like proteinase | -7.77 | -7.60 | N/A | N/A | N/A |
Glecaprevir | PR_PEDV | 3C-like proteinase | -9.79 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_PEDV | 3C-like proteinase | -7.93 | N/A | N/A | N/A | N/A |
Raltegravir | PR_PEDV | 3C-like proteinase | -8.14 | N/A | N/A | N/A | N/A |
Doravirine | PR_PEDV | 3C-like proteinase | -7.94 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_PEDV | 3C-like proteinase | -7.28 | N/A | N/A | N/A | N/A |
Glecaprevir | PR_SARS | Replicase polyprotein 1ab | -8.62 | -9.02 | -8.56 | 26.52% | CHEMBL2441745 |
Pibrentasvir | PR_SARS | Replicase polyprotein 1ab | -8.09 | -7.76 | -8.18 | 35.86% | CHEMBL2441741 |
Raltegravir | PR_SARS | Replicase polyprotein 1ab | -8.96 | -8.58 | -8.26 | 21.62% | CHEMBL2441745 |
Doravirine | PR_SARS | Replicase polyprotein 1ab | -7.92 | -7.38 | -8.38 | 21.40% | CHEMBL221366 |
Fosamprenavir | PR_SARS | Replicase polyprotein 1ab | -7.36 | -7.42 | -7.09 | 34.58% | CHEMBL2441745 |
Glecaprevir | PR_SARS2 | 3C-like protease | -8.73 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_SARS2 | 3C-like protease | -8.47 | N/A | N/A | N/A | N/A |
Raltegravir | PR_SARS2 | 3C-like protease | -8.43 | N/A | N/A | N/A | N/A |
Doravirine | PR_SARS2 | 3C-like protease | -8.34 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_SARS2 | 3C-like protease | -8.03 | N/A | N/A | N/A | N/A |
Glecaprevir | PR_TGEV | Replicase polyprotein 1a | -8.91 | N/A | N/A | N/A | N/A |
Pibrentasvir | PR_TGEV | Replicase polyprotein 1a | -8.32 | N/A | N/A | N/A | N/A |
Raltegravir | PR_TGEV | Replicase polyprotein 1a | -8.21 | N/A | N/A | N/A | N/A |
Doravirine | PR_TGEV | Replicase polyprotein 1a | -7.59 | N/A | N/A | N/A | N/A |
Fosamprenavir | PR_TGEV | Replicase polyprotein 1a | -6.67 | N/A | N/A | N/A | N/A |
Glecaprevir | RT_HIV1 | Gag-Pol polyprotein | -11.64 | -10.49 | -9.43 | 36.68% | CHEMBL3683705 |
Pibrentasvir | RT_HIV1 | Gag-Pol polyprotein | 0.94 | 2.35 | ? | ? | ? |
Raltegravir | RT_HIV1 | Gag-Pol polyprotein | -9.77 | -9.27 | -10.17 | 29.66% | CHEMBL4109767 |
Doravirine | RT_HIV1 | Gag-Pol polyprotein | -9.76 | -9.62 | -9.58 | 25.78% | CHEMBL4227326 |
Fosamprenavir | RT_HIV1 | Gag-Pol polyprotein | -8.78 | -8.59 | -8.83 | 56.50% | CHEMBL3683710 |
Glecaprevir | SPIKE_HCoV-229E | Spike glycoprotein | -6.76 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_HCoV-229E | Spike glycoprotein | -6.33 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_HCoV-229E | Spike glycoprotein | -5.97 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_HCoV-229E | Spike glycoprotein | -5.72 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_HCoV-229E | Spike glycoprotein | -4.85 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_HCoV-NL63 | Spike glycoprotein | -7.56 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_HCoV-NL63 | Spike glycoprotein | -7.09 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_HCoV-NL63 | Spike glycoprotein | -6.54 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_HCoV-NL63 | Spike glycoprotein | -6.53 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_HCoV-NL63 | Spike glycoprotein | -5.14 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_HCoV-OC43 | Spike glycoprotein | -8.82 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_HCoV-OC43 | Spike glycoprotein | -7.27 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_HCoV-OC43 | Spike glycoprotein | -7.52 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_HCoV-OC43 | Spike glycoprotein | -7.10 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_HCoV-OC43 | Spike glycoprotein | -6.19 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_HKU4 | Spike glycoprotein | -7.23 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_HKU4 | Spike glycoprotein | -8.24 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_HKU4 | Spike glycoprotein | -8.03 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_HKU4 | Spike glycoprotein | -6.99 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_HKU4 | Spike glycoprotein | -6.99 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_IBV | Spike glycoprotein | -8.21 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_IBV | Spike glycoprotein | -6.40 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_IBV | Spike glycoprotein | -7.51 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_IBV | Spike glycoprotein | -6.00 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_IBV | Spike glycoprotein | -6.16 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_MERs | Spike glycoprotein | -8.22 | -7.94 | -6.92 | N/A | N/A |
Pibrentasvir | SPIKE_MERs | Spike glycoprotein | -8.86 | -7.90 | -7.36 | N/A | N/A |
Raltegravir | SPIKE_MERs | Spike glycoprotein | -7.91 | -8.23 | -6.45 | N/A | N/A |
Doravirine | SPIKE_MERs | Spike glycoprotein | -6.88 | -6.48 | -5.94 | N/A | N/A |
Fosamprenavir | SPIKE_MERs | Spike glycoprotein | -6.57 | -6.12 | -4.72 | N/A | N/A |
Glecaprevir | SPIKE_MHV | Spike glycoprotein | -10.02 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_MHV | Spike glycoprotein | -7.18 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_MHV | Spike glycoprotein | -7.89 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_MHV | Spike glycoprotein | -7.24 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_MHV | Spike glycoprotein | -6.81 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_PDCoV | Spike protein | -8.24 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_PDCoV | Spike protein | -6.81 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_PDCoV | Spike protein | -7.43 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_PDCoV | Spike protein | -7.02 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_PDCoV | Spike protein | -5.92 | N/A | N/A | N/A | N/A |
Glecaprevir | SPIKE_SARS | Spike glycoprotein | -7.07 | -8.24 | N/A | N/A | N/A |
Pibrentasvir | SPIKE_SARS | Spike glycoprotein | -7.74 | -8.00 | N/A | N/A | N/A |
Raltegravir | SPIKE_SARS | Spike glycoprotein | -7.27 | -6.86 | N/A | N/A | N/A |
Doravirine | SPIKE_SARS | Spike glycoprotein | -6.88 | -7.63 | N/A | N/A | N/A |
Fosamprenavir | SPIKE_SARS | Spike glycoprotein | -5.95 | -6.33 | N/A | N/A | N/A |
Glecaprevir | SPIKE_SARS2 | Spike glycoprotein | -7.61 | N/A | N/A | N/A | N/A |
Pibrentasvir | SPIKE_SARS2 | Spike glycoprotein | -7.34 | N/A | N/A | N/A | N/A |
Raltegravir | SPIKE_SARS2 | Spike glycoprotein | -6.76 | N/A | N/A | N/A | N/A |
Doravirine | SPIKE_SARS2 | Spike glycoprotein | -6.99 | N/A | N/A | N/A | N/A |
Fosamprenavir | SPIKE_SARS2 | Spike glycoprotein | -4.78 | N/A | N/A | N/A | N/A |