Ryan-Mini-Project-1 #526 Output Download CSV

Gene Protein
 
  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
Paxlovid 2A_HE71 Genome polyprotein -7.45 N/A N/A N/A N/A
Molnupiravir 2A_HE71 Genome polyprotein -7.49 N/A N/A N/A N/A
Paxlovid 2A_HE71M Genome polyprotein -8.46 N/A N/A N/A N/A
Molnupiravir 2A_HE71M Genome polyprotein -7.51 N/A N/A N/A N/A
Paxlovid 2C_HE71 Genome polyprotein -5.43 -6.52 N/A N/A N/A
Molnupiravir 2C_HE71 Genome polyprotein -5.41 -6.27 N/A N/A N/A
Paxlovid 3A_9ENTO Genome polyprotein -5.72 N/A N/A N/A N/A
Molnupiravir 3A_9ENTO Genome polyprotein -5.95 N/A N/A N/A N/A
Paxlovid 3A_HE71M Genome polyprotein -4.89 N/A N/A N/A N/A
Molnupiravir 3A_HE71M Genome polyprotein -5.50 N/A N/A N/A N/A
Paxlovid 3A_HED68 Genome polyprotein -4.98 N/A N/A N/A N/A
Molnupiravir 3A_HED68 Genome polyprotein -5.78 N/A N/A N/A N/A
Paxlovid 3C_HE71 Genome polyprotein -6.50 -6.06 N/A N/A N/A
Molnupiravir 3C_HE71 Genome polyprotein -5.88 -6.25 N/A N/A N/A
Paxlovid 3C_HED68 Genome polyprotein -6.33 N/A N/A N/A N/A
Molnupiravir 3C_HED68 Genome polyprotein -5.47 N/A N/A N/A N/A
Paxlovid 3D_HE71 Genome polyprotein -7.73 N/A N/A N/A N/A
Molnupiravir 3D_HE71 Genome polyprotein -7.52 N/A N/A N/A N/A
Paxlovid 3D_HED68 Genome polyprotein -7.99 N/A N/A N/A N/A
Molnupiravir 3D_HED68 Genome polyprotein -7.33 N/A N/A N/A N/A
Paxlovid ACE2_HUMAN angiotensin converting enzyme 2 -9.56 N/A N/A 38.64% CHEMBL254900
Molnupiravir ACE2_HUMAN angiotensin converting enzyme 2 -9.09 N/A N/A 21.43% CHEMBL429844
Paxlovid CAPSD_9CALI Capsid protein -7.98 -6.68 -7.93 N/A N/A
Molnupiravir CAPSD_9CALI Capsid protein -7.01 -6.94 -7.75 N/A N/A
Paxlovid CAPSD_9ENTO Genome polyprotein -6.30 N/A N/A N/A N/A
Molnupiravir CAPSD_9ENTO Genome polyprotein -8.98 N/A N/A N/A N/A
Paxlovid CAPSD_DEN2P Genome polyprotein -5.95 N/A N/A N/A N/A
Molnupiravir CAPSD_DEN2P Genome polyprotein -5.67 N/A N/A N/A N/A
Paxlovid CAPSD_HCV77 Genome polyprotein -4.38 N/A N/A 60.67% CHEMBL296588
Molnupiravir CAPSD_HCV77 Genome polyprotein -4.44 N/A N/A 41.77% CHEMBL3696815
Paxlovid CAPSD_HED68 Capsid protein VP0 -8.13 -9.58 N/A N/A N/A
Molnupiravir CAPSD_HED68 Capsid protein VP0 -7.55 -7.96 N/A N/A N/A
Paxlovid CAPSD_ZIKV Core protein -6.13 -5.91 N/A N/A N/A
Molnupiravir CAPSD_ZIKV Core protein -5.90 -5.24 N/A N/A N/A
Paxlovid DPM_HHV1K DNA polymerase catalytic subunit -7.76 N/A N/A 16.31% CHEMBL479371
Molnupiravir DPM_HHV1K DNA polymerase catalytic subunit -7.73 N/A N/A 17.36% CHEMBL479371
Paxlovid E1_9HEPC Envelope glycoprotein E1 -5.33 N/A N/A N/A N/A
Molnupiravir E1_9HEPC Envelope glycoprotein E1 -5.28 N/A N/A N/A N/A
Paxlovid E1_HCV77 Genome polyprotein -4.66 N/A N/A 60.67% CHEMBL296588
Molnupiravir E1_HCV77 Genome polyprotein -3.96 N/A N/A 41.77% CHEMBL3696815
Paxlovid E1_HCVJ1 Genome polyprotein -4.49 N/A N/A N/A N/A
Molnupiravir E1_HCVJ1 Genome polyprotein -4.64 N/A N/A N/A N/A
Paxlovid E2_9HEPC Core protein precursor -7.81 N/A N/A N/A N/A
Molnupiravir E2_9HEPC Core protein precursor -8.23 N/A N/A N/A N/A
Paxlovid E2_HCV77 Genome polyprotein -5.82 N/A N/A 60.67% CHEMBL296588
Molnupiravir E2_HCV77 Genome polyprotein -6.10 N/A N/A 41.77% CHEMBL3696815
Paxlovid ENV_9FLAV Envelope protein E -5.89 N/A N/A N/A N/A
Molnupiravir ENV_9FLAV Envelope protein E -5.47 N/A N/A N/A N/A
Paxlovid ENV_DEN1B Genome polyprotein -5.39 N/A N/A N/A N/A
Molnupiravir ENV_DEN1B Genome polyprotein -4.79 N/A N/A N/A N/A
Paxlovid ENV_DEN2P Genome polyprotein -7.00 N/A N/A N/A N/A
Molnupiravir ENV_DEN2P Genome polyprotein -6.51 N/A N/A N/A N/A
Paxlovid ENV_DEN3P Genome polyprotein -5.60 N/A N/A N/A N/A
Molnupiravir ENV_DEN3P Genome polyprotein -5.58 N/A N/A N/A N/A
Paxlovid ENV_HHV2H Envelope glycoprotein H -6.84 N/A N/A N/A N/A
Molnupiravir ENV_HHV2H Envelope glycoprotein H -6.23 N/A N/A N/A N/A
Paxlovid ENV_ZIKV Core protein -5.67 N/A N/A N/A N/A
Molnupiravir ENV_ZIKV Core protein -5.83 N/A N/A N/A N/A
Paxlovid ENV_ZIKVK Genome polyprotein -6.46 N/A N/A N/A N/A
Molnupiravir ENV_ZIKVK Genome polyprotein -5.96 N/A N/A N/A N/A
Paxlovid G1_ADNV Envelope polyprotein -3.85 -6.25 -6.33 N/A N/A
Molnupiravir G1_ADNV Envelope polyprotein -4.09 -6.30 -5.95 N/A N/A
Paxlovid G2_ADNV Envelope polyprotein -7.41 -6.92 -6.95 N/A N/A
Molnupiravir G2_ADNV Envelope polyprotein -8.24 -7.79 -6.92 N/A N/A
Paxlovid GB_HHV11 Envelope glycoprotein B -7.10 N/A N/A N/A N/A
Molnupiravir GB_HHV11 Envelope glycoprotein B -6.38 N/A N/A N/A N/A
Paxlovid GB_HHV1K Envelope glycoprotein B -7.10 -6.68 N/A N/A N/A
Molnupiravir GB_HHV1K Envelope glycoprotein B -6.64 -6.60 N/A N/A N/A
Paxlovid GD_9ALPH Glycoprotein D -7.63 -5.57 N/A N/A N/A
Molnupiravir GD_9ALPH Glycoprotein D -6.87 -6.25 N/A N/A N/A
Paxlovid GD_HHV1 Glycoprotein D -6.54 N/A N/A N/A N/A
Molnupiravir GD_HHV1 Glycoprotein D -6.14 N/A N/A N/A N/A
Paxlovid GP160_HIV1 Envelope glycoprotein gp160 -6.64 -6.16 -6.17 N/A N/A
Molnupiravir GP160_HIV1 Envelope glycoprotein gp160 -6.32 -6.36 -6.27 N/A N/A
Paxlovid GP160_HIV2 Envelope glycoprotein gp160 -6.36 N/A N/A N/A N/A
Molnupiravir GP160_HIV2 Envelope glycoprotein gp160 -6.86 N/A N/A N/A N/A
Paxlovid GP_EBOV Envelope glycoprotein -7.37 -7.05 -7.11 33.54% CHEMBL3125897
Molnupiravir GP_EBOV Envelope glycoprotein -7.17 -6.29 -6.20 19.27% CHEMBL3125895
Paxlovid GP_LASSJ Pre-glycoprotein polyprotein GP complex -6.12 -6.16 N/A N/A N/A
Molnupiravir GP_LASSJ Pre-glycoprotein polyprotein GP complex -6.42 -6.85 N/A N/A N/A
Paxlovid HA_A-H10N7 Hemagglutinin -6.87 N/A N/A N/A N/A
Molnupiravir HA_A-H10N7 Hemagglutinin -6.68 N/A N/A N/A N/A
Paxlovid HA_A-H10N8 Hemagglutinin -6.50 N/A N/A N/A N/A
Molnupiravir HA_A-H10N8 Hemagglutinin -5.51 N/A N/A N/A N/A
Paxlovid HA_A-H13N6 Hemagglutinin -5.98 N/A N/A N/A N/A
Molnupiravir HA_A-H13N6 Hemagglutinin -6.69 N/A N/A N/A N/A
Paxlovid HA_A-H14N6 Hemagglutinin -6.49 N/A N/A N/A N/A
Molnupiravir HA_A-H14N6 Hemagglutinin -7.36 N/A N/A N/A N/A
Paxlovid HA_A-H15N9 Hemagglutinin -6.32 N/A N/A N/A N/A
Molnupiravir HA_A-H15N9 Hemagglutinin -6.64 N/A N/A N/A N/A
Paxlovid HA_A-H17N10 Hemagglutinin -6.07 N/A N/A N/A N/A
Molnupiravir HA_A-H17N10 Hemagglutinin -5.90 N/A N/A N/A N/A
Paxlovid HA_A-H18N11 Hemagglutinin -5.59 N/A N/A N/A N/A
Molnupiravir HA_A-H18N11 Hemagglutinin -5.68 N/A N/A N/A N/A
Paxlovid HA_A-H1N1 Hemagglutinin -6.70 -6.74 N/A N/A N/A
Molnupiravir HA_A-H1N1 Hemagglutinin -6.67 -6.23 N/A N/A N/A
Paxlovid HA_A-H2N2 Hemagglutinin -6.49 -6.66 N/A N/A N/A
Molnupiravir HA_A-H2N2 Hemagglutinin -6.29 -6.41 N/A N/A N/A
Paxlovid HA_A-H3N2 Hemagglutinin -6.20 -6.39 -6.16 N/A N/A
Molnupiravir HA_A-H3N2 Hemagglutinin -5.81 -5.95 -6.05 N/A N/A
Paxlovid HA_A-H3N8 Hemagglutinin -5.92 -5.77 -5.89 N/A N/A
Molnupiravir HA_A-H3N8 Hemagglutinin -5.74 -6.13 -5.82 N/A N/A
Paxlovid HA_A-H5N1 Hemagglutinin -6.59 -6.13 -6.30 N/A N/A
Molnupiravir HA_A-H5N1 Hemagglutinin -6.72 -6.96 -6.22 N/A N/A
Paxlovid HA_A-H5N3 Hemagglutinin -6.36 -6.10 N/A N/A N/A
Molnupiravir HA_A-H5N3 Hemagglutinin -7.15 -6.40 N/A N/A N/A
Paxlovid HA_A-H6N1 Hemagglutinin -6.50 N/A N/A N/A N/A
Molnupiravir HA_A-H6N1 Hemagglutinin -5.51 N/A N/A N/A N/A
Paxlovid HA_A-H6N6 Hemagglutinin -6.41 N/A N/A N/A N/A
Molnupiravir HA_A-H6N6 Hemagglutinin -6.41 N/A N/A N/A N/A
Paxlovid HA_A-H7N2 Hemagglutinin -6.60 -6.46 -6.29 N/A N/A
Molnupiravir HA_A-H7N2 Hemagglutinin -6.49 -5.92 -6.26 N/A N/A
Paxlovid HA_A-H7N7 Hemagglutinin -6.12 -6.03 N/A N/A N/A
Molnupiravir HA_A-H7N7 Hemagglutinin -6.07 -6.60 N/A N/A N/A
Paxlovid HA_A-H7N9 Hemagglutinin -6.01 N/A N/A N/A N/A
Molnupiravir HA_A-H7N9 Hemagglutinin -6.23 N/A N/A N/A N/A
Paxlovid HA_INFB Hemagglutinin -6.36 -6.79 N/A N/A N/A
Molnupiravir HA_INFB Hemagglutinin -6.07 -6.41 N/A N/A N/A
Paxlovid HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.58 N/A N/A N/A N/A
Molnupiravir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.07 N/A N/A N/A N/A
Paxlovid HE_BCV Hemagglutinin-esterase -6.59 -6.77 N/A N/A N/A
Molnupiravir HE_BCV Hemagglutinin-esterase -5.96 -6.09 N/A N/A N/A
Paxlovid HE_HCoV-OC43 Hemagglutinin-esterase -6.07 N/A N/A N/A N/A
Molnupiravir HE_HCoV-OC43 Hemagglutinin-esterase -5.29 N/A N/A N/A N/A
Paxlovid HE_MHV Hemagglutinin-esterase -6.21 N/A N/A N/A N/A
Molnupiravir HE_MHV Hemagglutinin-esterase -5.57 N/A N/A N/A N/A
Paxlovid IN_HIV1 Gag-Pol polyprotein -5.82 -5.30 N/A N/A N/A
Molnupiravir IN_HIV1 Gag-Pol polyprotein -5.36 -5.32 N/A N/A N/A
Paxlovid MD_HKU4 Replicase polyprotein 1ab -9.37 -7.46 -8.86 N/A N/A
Molnupiravir MD_HKU4 Replicase polyprotein 1ab -8.78 -8.39 -8.01 N/A N/A
Paxlovid MD_MERs Replicase polyprotein 1a -8.51 -9.04 N/A N/A N/A
Molnupiravir MD_MERs Replicase polyprotein 1a -8.67 -8.19 N/A N/A N/A
Paxlovid MEM_9FLAV Core protein -5.33 N/A N/A N/A N/A
Molnupiravir MEM_9FLAV Core protein -5.46 N/A N/A N/A N/A
Paxlovid MTASE_SARS2 Methyltransferase -6.32 N/A N/A N/A N/A
Paxlovid MTASE_SARS2 Methyltransferase -7.19 N/A N/A N/A N/A
Molnupiravir MTASE_SARS2 Methyltransferase -5.93 N/A N/A N/A N/A
Molnupiravir MTASE_SARS2 Methyltransferase -7.65 N/A N/A N/A N/A
Paxlovid MX2_A-H5N1 Matrix protein 2 -0.02 N/A N/A N/A N/A
Molnupiravir MX2_A-H5N1 Matrix protein 2 -8.80 N/A N/A N/A N/A
Paxlovid MX_9MONO Matrix protein VP40 -8.15 N/A N/A N/A N/A
Molnupiravir MX_9MONO Matrix protein VP40 -7.66 N/A N/A N/A N/A
Paxlovid MX_LASSJ RING finger protein Z -5.33 N/A N/A N/A N/A
Molnupiravir MX_LASSJ RING finger protein Z -5.70 N/A N/A N/A N/A
Paxlovid NA_A-H11N6 Neuraminidase -7.44 -7.99 -7.64 N/A N/A
Molnupiravir NA_A-H11N6 Neuraminidase -7.63 -7.38 -7.63 N/A N/A
Paxlovid NA_A-H11N9 Neuraminidase -6.30 -7.75 -7.98 N/A N/A
Molnupiravir NA_A-H11N9 Neuraminidase -6.00 -7.51 -7.55 N/A N/A
Paxlovid NA_A-H12N5 Neuraminidase -6.77 -7.20 -7.46 N/A N/A
Molnupiravir NA_A-H12N5 Neuraminidase -7.31 -7.85 -7.62 N/A N/A
Paxlovid NA_A-H13N9 Neuraminidase -6.03 N/A N/A N/A N/A
Molnupiravir NA_A-H13N9 Neuraminidase -6.51 N/A N/A N/A N/A
Paxlovid NA_A-H17N10 Neuraminidase -6.89 N/A N/A N/A N/A
Molnupiravir NA_A-H17N10 Neuraminidase -6.60 N/A N/A N/A N/A
Paxlovid NA_A-H18N11 Neuraminidase -6.43 N/A N/A N/A N/A
Molnupiravir NA_A-H18N11 Neuraminidase -5.99 N/A N/A N/A N/A
Paxlovid NA_A-H1N1 Neuraminidase -7.42 N/A N/A N/A N/A
Molnupiravir NA_A-H1N1 Neuraminidase -7.28 N/A N/A N/A N/A
Paxlovid NA_A-H2N2 Neuraminidase -7.43 -7.70 -6.97 N/A N/A
Molnupiravir NA_A-H2N2 Neuraminidase -7.71 -7.29 -7.29 N/A N/A
Paxlovid NA_A-H3N2 Ig heavy chain Mem5 -7.38 -6.86 N/A N/A N/A
Molnupiravir NA_A-H3N2 Ig heavy chain Mem5 -6.59 -7.31 N/A N/A N/A
Paxlovid NA_A-H3N8 Neuraminidase -8.01 -8.13 -7.24 29.71% CHEMBL674
Molnupiravir NA_A-H3N8 Neuraminidase -7.73 -7.75 -7.38 22.31% CHEMBL222813
Paxlovid NA_A-H5N1 Neuraminidase -7.84 N/A N/A N/A N/A
Molnupiravir NA_A-H5N1 Neuraminidase -7.42 N/A N/A N/A N/A
Paxlovid NA_A-H7N9 Neuraminidase -7.38 -7.69 -7.66 N/A N/A
Molnupiravir NA_A-H7N9 Neuraminidase -7.14 -7.24 -7.34 N/A N/A
Paxlovid NA_INFB Neuraminidase -6.87 -6.97 N/A 55.10% CHEMBL370047
Molnupiravir NA_INFB Neuraminidase -7.79 -7.76 N/A 28.81% CHEMBL183817
Paxlovid NP_9ADNV Nucleoprotein -5.19 -7.17 N/A N/A N/A
Molnupiravir NP_9ADNV Nucleoprotein -5.19 -7.30 N/A N/A N/A
Paxlovid NP_A-H1N1 Nucleoprotein -6.37 -6.19 -6.28 N/A N/A
Molnupiravir NP_A-H1N1 Nucleoprotein -5.40 -5.82 -7.17 N/A N/A
Paxlovid NP_A-H5N1 Nucleoprotein -6.09 N/A N/A N/A N/A
Molnupiravir NP_A-H5N1 Nucleoprotein -6.33 N/A N/A N/A N/A
Paxlovid NP_EBOZM Nucleoprotein -7.14 -5.80 -6.69 N/A N/A
Molnupiravir NP_EBOZM Nucleoprotein -5.57 -5.85 -6.31 N/A N/A
Paxlovid NP_HCoV-NL63 Nucleoprotein -6.87 N/A N/A N/A N/A
Molnupiravir NP_HCoV-NL63 Nucleoprotein -6.43 N/A N/A N/A N/A
Paxlovid NP_HCoV-OC43 Nucleoprotein -7.26 -7.30 -7.46 15.25% CHEMBL3233481
Molnupiravir NP_HCoV-OC43 Nucleoprotein -7.18 -6.86 -6.53 11.54% CHEMBL3233481
Paxlovid NP_INFB Nucleoprotein -6.15 N/A N/A N/A N/A
Molnupiravir NP_INFB Nucleoprotein -5.82 N/A N/A N/A N/A
Paxlovid NP_INFD NP -5.38 N/A N/A N/A N/A
Molnupiravir NP_INFD NP -5.11 N/A N/A N/A N/A
Paxlovid NP_LASSJ Nucleoprotein -9.16 -8.97 -4.95 N/A N/A
Molnupiravir NP_LASSJ Nucleoprotein -8.49 -8.45 -4.97 N/A N/A
Paxlovid NP_SARS Nucleoprotein -6.90 N/A N/A N/A N/A
Molnupiravir NP_SARS Nucleoprotein -6.64 N/A N/A N/A N/A
Paxlovid NS1_9CALI NTPase -5.80 -5.72 -6.34 N/A N/A
Molnupiravir NS1_9CALI NTPase -5.36 -5.49 -6.26 N/A N/A
Paxlovid NS1_9FLAV Non-structural protein 1 -5.80 N/A N/A N/A N/A
Molnupiravir NS1_9FLAV Non-structural protein 1 -5.50 N/A N/A N/A N/A
Paxlovid NS1_DEN1W Genome polyprotein -5.45 N/A N/A N/A N/A
Molnupiravir NS1_DEN1W Genome polyprotein -5.46 N/A N/A N/A N/A
Paxlovid NS1_ZIKV Core protein 2.87 -6.03 -7.37 N/A N/A
Molnupiravir NS1_ZIKV Core protein -6.60 -6.35 -6.61 N/A N/A
Paxlovid NS2A_9FLAV Core protein -4.39 N/A N/A N/A N/A
Molnupiravir NS2A_9FLAV Core protein -4.11 N/A N/A N/A N/A
Paxlovid NS2B_DEN1W Genome polyprotein -6.93 N/A N/A N/A N/A
Molnupiravir NS2B_DEN1W Genome polyprotein -6.90 N/A N/A N/A N/A
Paxlovid NS2B_DEN2P Genome polyprotein -7.35 -7.63 N/A N/A N/A
Molnupiravir NS2B_DEN2P Genome polyprotein -6.79 -6.77 N/A N/A N/A
Paxlovid NS2B_ZIKV Genome polyprotein -6.46 -6.65 N/A N/A N/A
Molnupiravir NS2B_ZIKV Genome polyprotein -6.70 -6.77 N/A N/A N/A
Paxlovid NS2B_ZIKVF Genome polyprotein -7.51 N/A N/A N/A N/A
Molnupiravir NS2B_ZIKVF Genome polyprotein -6.65 N/A N/A N/A N/A
Paxlovid NS3_9FLAV Core protein -8.39 N/A N/A N/A N/A
Molnupiravir NS3_9FLAV Core protein -7.57 N/A N/A N/A N/A
Paxlovid NS3_DEN4T Genome polyprotein -7.96 -7.55 N/A N/A N/A
Molnupiravir NS3_DEN4T Genome polyprotein -8.03 -6.94 N/A N/A N/A
Paxlovid NS3_HCV1A Genome polyprotein -6.26 -6.12 -6.26 60.67% CHEMBL296588
Molnupiravir NS3_HCV1A Genome polyprotein -8.08 -5.97 -7.11 41.77% CHEMBL3696815
Paxlovid NS3_HCV1B Genome polyprotein -6.27 -7.45 -6.02 50.50% CHEMBL3921185
Molnupiravir NS3_HCV1B Genome polyprotein -7.79 -7.13 -5.79 20.82% CHEMBL3954962
Paxlovid NS3_HCV3A Genome polyprotein -6.72 -6.58 -7.07 N/A N/A
Molnupiravir NS3_HCV3A Genome polyprotein -6.73 -6.73 -7.01 N/A N/A
Paxlovid NS3_ZIKV Genome polyprotein -8.14 N/A N/A N/A N/A
Molnupiravir NS3_ZIKV Genome polyprotein -7.72 N/A N/A N/A N/A
Paxlovid NS5B_HCV1A Genome polyprotein -7.93 -8.39 -8.08 52.00% CHEMBL13443
Molnupiravir NS5B_HCV1A Genome polyprotein -7.43 -7.12 -7.08 21.98% CHEMBL3644925
Paxlovid NS5B_HCV1B Genome polyprotein -7.79 -7.93 -7.97 20.75% CHEMBL3422106
Molnupiravir NS5B_HCV1B Genome polyprotein -6.91 -7.88 -7.48 22.18% CHEMBL3970609
Paxlovid NS5B_HCV2A Genome polyprotein -9.02 -5.57 N/A 34.72% CHEMBL3127326
Molnupiravir NS5B_HCV2A Genome polyprotein -8.92 -8.21 N/A 16.00% CHEMBL3127326
Paxlovid NS5_9FLAV Core protein -8.00 N/A N/A N/A N/A
Molnupiravir NS5_9FLAV Core protein -8.00 N/A N/A N/A N/A
Paxlovid NS5_DEN3S Genome polyprotein -6.36 -7.11 N/A N/A N/A
Molnupiravir NS5_DEN3S Genome polyprotein -7.11 -7.87 N/A N/A N/A
Paxlovid NS5_ZIKV Genome polyprotein -8.24 -5.64 N/A N/A N/A
Molnupiravir NS5_ZIKV Genome polyprotein -7.81 -5.25 N/A N/A N/A
Paxlovid NS5_ZIKVF Genome polyprotein -7.36 N/A N/A N/A N/A
Molnupiravir NS5_ZIKVF Genome polyprotein -7.24 N/A N/A N/A N/A
Paxlovid NS6_9CALI NTPase -4.79 -5.44 -6.18 N/A N/A
Molnupiravir NS6_9CALI NTPase -4.75 -5.70 -5.87 N/A N/A
Paxlovid NSP15_SARS Replicase polyprotein 1ab -7.11 N/A N/A 42.31% CHEMBL2441741
Molnupiravir NSP15_SARS Replicase polyprotein 1ab -6.07 N/A N/A 18.10% CHEMBL2441745
Paxlovid NSP15_SARS2 Replicase polyprotein 1ab -6.57 N/A N/A N/A N/A
Molnupiravir NSP15_SARS2 Replicase polyprotein 1ab -6.83 N/A N/A N/A N/A
Paxlovid NSP1_INFB Non-structural protein 1 -5.73 -6.05 N/A N/A N/A
Molnupiravir NSP1_INFB Non-structural protein 1 -5.57 -5.26 N/A N/A N/A
Paxlovid NSP1_SARS Replicase polyprotein 1ab -5.83 N/A N/A 42.31% CHEMBL2441741
Molnupiravir NSP1_SARS Replicase polyprotein 1ab -5.87 N/A N/A 18.10% CHEMBL2441745
Paxlovid NSP3_HCoV-229E Replicase polyprotein 1a -8.42 N/A N/A N/A N/A
Molnupiravir NSP3_HCoV-229E Replicase polyprotein 1a -9.71 N/A N/A N/A N/A
Paxlovid NSP3_IBV Replicase polyprotein 1a -6.70 N/A N/A N/A N/A
Molnupiravir NSP3_IBV Replicase polyprotein 1a -9.52 N/A N/A N/A N/A
Paxlovid NSP3_MHV Replicase polyprotein 1ab -6.90 N/A N/A N/A N/A
Molnupiravir NSP3_MHV Replicase polyprotein 1ab -6.14 N/A N/A N/A N/A
Paxlovid NSP3_SARS2 Replicase polyprotein 1ab -6.88 N/A N/A N/A N/A
Molnupiravir NSP3_SARS2 Replicase polyprotein 1ab -6.92 N/A N/A N/A N/A
Paxlovid NSP9_HCoV-229E Replicase polyprotein 1ab -6.85 -6.22 N/A N/A N/A
Molnupiravir NSP9_HCoV-229E Replicase polyprotein 1ab -6.64 -6.23 N/A N/A N/A
Paxlovid PA_A-H17N10 Polymerase acidic protein -7.85 N/A N/A N/A N/A
Molnupiravir PA_A-H17N10 Polymerase acidic protein -7.99 N/A N/A N/A N/A
Paxlovid PA_A-H1N1 Polymerase acidic protein -8.01 -7.89 -7.62 N/A N/A
Molnupiravir PA_A-H1N1 Polymerase acidic protein -7.73 -7.95 -8.26 N/A N/A
Paxlovid PA_A-H5N1 Polymerase acidic protein -8.00 -7.66 -7.53 N/A N/A
Molnupiravir PA_A-H5N1 Polymerase acidic protein -8.19 -7.94 -7.88 N/A N/A
Paxlovid PA_INFA Polymerase acidic protein -7.55 -7.78 -7.43 24.03% CHEMBL2040554
Molnupiravir PA_INFA Polymerase acidic protein -7.32 -8.08 -7.92 24.75% CHEMBL3944613
Paxlovid PA_INFB Polymerase acidic protein -6.97 N/A N/A N/A N/A
Molnupiravir PA_INFB Polymerase acidic protein -7.16 N/A N/A N/A N/A
Paxlovid PB2_A-H3N2 Polymerase basic protein 2 -7.65 -7.85 N/A N/A N/A
Molnupiravir PB2_A-H3N2 Polymerase basic protein 2 -6.75 -7.37 N/A N/A N/A
Paxlovid PB2_A-H5N1 Polymerase basic protein 2 -6.80 -7.51 -7.82 N/A N/A
Molnupiravir PB2_A-H5N1 Polymerase basic protein 2 -6.84 -6.68 -7.11 N/A N/A
Paxlovid PB2_INFB Polymerase basic protein 2 -6.70 N/A N/A N/A N/A
Molnupiravir PB2_INFB Polymerase basic protein 2 -7.04 N/A N/A N/A N/A
Paxlovid PB3_A-H3N2 Polymerase basic protein 2 -7.75 N/A N/A N/A N/A
Molnupiravir PB3_A-H3N2 Polymerase basic protein 2 -7.40 N/A N/A N/A N/A
Paxlovid PB4_A-H3N2 Polymerase basic protein 2 -7.68 N/A N/A N/A N/A
Molnupiravir PB4_A-H3N2 Polymerase basic protein 2 -7.07 N/A N/A N/A N/A
Paxlovid PLP_SARS Replicase polyprotein 1a -7.55 -7.00 -8.29 42.86% CHEMBL213054
Molnupiravir PLP_SARS Replicase polyprotein 1a -7.99 -7.86 -8.13 20.66% CHEMBL213054
Paxlovid PLP_SARS2 papain-like protease -6.84 N/A N/A N/A N/A
Molnupiravir PLP_SARS2 papain-like protease -7.28 N/A N/A N/A N/A
Paxlovid PM_9VIRU RNA-directed RNA polymerase L -7.24 -6.94 N/A N/A N/A
Molnupiravir PM_9VIRU RNA-directed RNA polymerase L -7.17 -7.13 N/A N/A N/A
Paxlovid PR_FCoV Replicase polyprotein 1ab -7.28 N/A N/A 52.83% CHEMBL4214066
Molnupiravir PR_FCoV Replicase polyprotein 1ab -6.62 N/A N/A 17.44% CHEMBL4214066
Paxlovid PR_HCoV-229E Replicase polyprotein 1a -7.35 -7.41 N/A N/A N/A
Molnupiravir PR_HCoV-229E Replicase polyprotein 1a -7.68 -7.20 N/A N/A N/A
Paxlovid PR_HCoV-NL63 Replicase polyprotein 1a -4.74 -8.08 N/A N/A N/A
Molnupiravir PR_HCoV-NL63 Replicase polyprotein 1a -5.00 -7.44 N/A N/A N/A
Paxlovid PR_HIV1 Gag-Pol polyprotein -6.33 -6.30 -6.29 17.03% CHEMBL492666
Molnupiravir PR_HIV1 Gag-Pol polyprotein -6.03 -6.15 -6.17 28.51% CHEMBL3645127
Paxlovid PR_HIV2 Gag-Pol polyprotein -6.88 -7.01 N/A N/A N/A
Molnupiravir PR_HIV2 Gag-Pol polyprotein -6.65 -5.98 N/A N/A N/A
Paxlovid PR_HKU1 Replicase polyprotein 1a -6.91 N/A N/A N/A N/A
Molnupiravir PR_HKU1 Replicase polyprotein 1a -6.67 N/A N/A N/A N/A
Paxlovid PR_HKU4 Replicase polyprotein 1ab -7.66 -7.71 -7.54 N/A N/A
Molnupiravir PR_HKU4 Replicase polyprotein 1ab -7.18 -6.89 -6.44 N/A N/A
Paxlovid PR_IBV Replicase polyprotein 1a -7.73 N/A N/A N/A N/A
Molnupiravir PR_IBV Replicase polyprotein 1a -7.31 N/A N/A N/A N/A
Paxlovid PR_MERs 3C-like proteinase -6.92 -7.91 N/A N/A N/A
Molnupiravir PR_MERs 3C-like proteinase -7.31 -6.86 N/A N/A N/A
Paxlovid PR_PEDV 3C-like proteinase -7.12 N/A N/A N/A N/A
Molnupiravir PR_PEDV 3C-like proteinase -6.92 N/A N/A N/A N/A
Paxlovid PR_SARS Replicase polyprotein 1ab -8.10 -7.68 -7.07 42.31% CHEMBL2441741
Molnupiravir PR_SARS Replicase polyprotein 1ab -6.90 -7.30 -7.27 18.10% CHEMBL2441745
Paxlovid PR_SARS2 3C-like protease -7.63 N/A N/A N/A N/A
Molnupiravir PR_SARS2 3C-like protease -7.31 N/A N/A N/A N/A
Paxlovid PR_TGEV Replicase polyprotein 1a -6.40 N/A N/A N/A N/A
Molnupiravir PR_TGEV Replicase polyprotein 1a -6.40 N/A N/A N/A N/A
Paxlovid P_9CALI Norovirus P domain protein -6.90 N/A N/A N/A N/A
Molnupiravir P_9CALI Norovirus P domain protein -7.56 N/A N/A N/A N/A
Paxlovid P_NVN68 Capsid protein VP1 -5.79 N/A N/A N/A N/A
Molnupiravir P_NVN68 Capsid protein VP1 -5.32 N/A N/A N/A N/A
Paxlovid RDRP_SARS2 RNA-dependent RNA polymerase -6.21 N/A N/A 10.37% CHEMBL4065616
Molnupiravir RDRP_SARS2 RNA-dependent RNA polymerase -6.76 N/A N/A 23.68% CHEMBL4065616
Paxlovid RT_HIV1 Gag-Pol polyprotein -8.46 -8.68 -7.39 33.58% CHEMBL4225865
Molnupiravir RT_HIV1 Gag-Pol polyprotein -7.85 -8.20 -7.88 23.95% CHEMBL3683704
Paxlovid SPIKE_HCoV-229E Spike glycoprotein -5.10 N/A N/A N/A N/A
Molnupiravir SPIKE_HCoV-229E Spike glycoprotein -4.73 N/A N/A N/A N/A
Paxlovid SPIKE_HCoV-NL63 Spike glycoprotein -5.46 N/A N/A N/A N/A
Molnupiravir SPIKE_HCoV-NL63 Spike glycoprotein -5.14 N/A N/A N/A N/A
Paxlovid SPIKE_HCoV-OC43 Spike glycoprotein -6.79 N/A N/A N/A N/A
Molnupiravir SPIKE_HCoV-OC43 Spike glycoprotein -6.44 N/A N/A N/A N/A
Paxlovid SPIKE_HKU4 Spike glycoprotein -7.52 N/A N/A N/A N/A
Molnupiravir SPIKE_HKU4 Spike glycoprotein -7.35 N/A N/A N/A N/A
Paxlovid SPIKE_IBV Spike glycoprotein -6.28 N/A N/A N/A N/A
Molnupiravir SPIKE_IBV Spike glycoprotein -5.41 N/A N/A N/A N/A
Paxlovid SPIKE_MERs Spike glycoprotein -6.61 -6.35 -5.98 N/A N/A
Molnupiravir SPIKE_MERs Spike glycoprotein -6.43 -5.90 -5.33 N/A N/A
Paxlovid SPIKE_MHV Spike glycoprotein -7.81 N/A N/A N/A N/A
Molnupiravir SPIKE_MHV Spike glycoprotein -7.00 N/A N/A N/A N/A
Paxlovid SPIKE_PDCoV Spike protein -6.79 N/A N/A N/A N/A
Molnupiravir SPIKE_PDCoV Spike protein -6.17 N/A N/A N/A N/A
Paxlovid SPIKE_SARS Spike glycoprotein -5.72 -6.56 N/A N/A N/A
Molnupiravir SPIKE_SARS Spike glycoprotein -5.92 -6.70 N/A N/A N/A
Paxlovid SPIKE_SARS2 Spike glycoprotein -5.43 -5.89 -6.47 N/A N/A
Molnupiravir SPIKE_SARS2 Spike glycoprotein -5.51 -5.83 -6.13 N/A N/A
Paxlovid VP1_9CALI Capsid protein -8.05 N/A N/A N/A N/A
Molnupiravir VP1_9CALI Capsid protein -7.74 N/A N/A N/A N/A
Paxlovid VP1_NVN68 Capsid protein VP1 -6.42 N/A N/A N/A N/A
Molnupiravir VP1_NVN68 Capsid protein VP1 -6.11 N/A N/A N/A N/A
Paxlovid VP24_EBORE Membrane-associated protein VP24 -5.67 N/A N/A N/A N/A
Molnupiravir VP24_EBORE Membrane-associated protein VP24 -4.87 N/A N/A N/A N/A
Paxlovid VP24_EBOSU Membrane-associated protein VP24 -5.25 N/A N/A N/A N/A
Molnupiravir VP24_EBOSU Membrane-associated protein VP24 -4.79 N/A N/A N/A N/A
Paxlovid VP24_EBOZM Membrane-associated protein VP24 -5.62 N/A N/A N/A N/A
Molnupiravir VP24_EBOZM Membrane-associated protein VP24 -5.32 N/A N/A N/A N/A
Paxlovid VP30_9MONO Minor nucleoprotein VP30 -6.09 N/A N/A N/A N/A
Molnupiravir VP30_9MONO Minor nucleoprotein VP30 -5.18 N/A N/A N/A N/A
Paxlovid VP30_EBOZ5 Transcriptional activator VP30 -6.52 N/A N/A N/A N/A
Molnupiravir VP30_EBOZ5 Transcriptional activator VP30 -6.22 N/A N/A N/A N/A
Paxlovid VP30_EBOZM Transcriptional activator VP30 -6.83 N/A N/A N/A N/A
Molnupiravir VP30_EBOZM Transcriptional activator VP30 -6.54 N/A N/A N/A N/A
Paxlovid VP35_EBORR Polymerase cofactor VP35 -6.00 N/A N/A N/A N/A
Molnupiravir VP35_EBORR Polymerase cofactor VP35 -5.52 N/A N/A N/A N/A
Paxlovid VP35_EBOZM Polymerase cofactor VP35 -6.25 -6.70 -6.52 N/A N/A
Molnupiravir VP35_EBOZM Polymerase cofactor VP35 -5.60 -6.02 -5.41 N/A N/A
Paxlovid VP40_EBOZM Matrix protein VP40 -5.17 -4.92 N/A N/A N/A
Molnupiravir VP40_EBOZM Matrix protein VP40 -4.82 -4.99 N/A N/A N/A