Nirmatrelvir modification #418 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
Nirmatrelvir Modify 2A_HE71 Genome polyprotein -7.36 N/A N/A N/A N/A
Nirmatrelvir 2A_HE71 Genome polyprotein -7.41 N/A N/A N/A N/A
Nirmatrelvir Modify 2A_HE71M Genome polyprotein -7.86 N/A N/A N/A N/A
Nirmatrelvir 2A_HE71M Genome polyprotein -6.98 N/A N/A N/A N/A
Nirmatrelvir Modify 2C_HE71 Genome polyprotein -5.45 -5.92 N/A N/A N/A
Nirmatrelvir 2C_HE71 Genome polyprotein -5.65 -6.15 N/A N/A N/A
Nirmatrelvir Modify 3A_9ENTO Genome polyprotein -6.17 N/A N/A N/A N/A
Nirmatrelvir 3A_9ENTO Genome polyprotein -5.77 N/A N/A N/A N/A
Nirmatrelvir Modify 3A_HE71M Genome polyprotein -6.01 N/A N/A N/A N/A
Nirmatrelvir 3A_HE71M Genome polyprotein -5.35 N/A N/A N/A N/A
Nirmatrelvir Modify 3A_HED68 Genome polyprotein -6.92 N/A N/A N/A N/A
Nirmatrelvir 3A_HED68 Genome polyprotein -6.52 N/A N/A N/A N/A
Nirmatrelvir Modify 3C_HE71 Genome polyprotein -7.23 -6.74 N/A N/A N/A
Nirmatrelvir 3C_HE71 Genome polyprotein -6.78 -6.46 N/A N/A N/A
Nirmatrelvir Modify 3C_HED68 Genome polyprotein -6.70 N/A N/A N/A N/A
Nirmatrelvir 3C_HED68 Genome polyprotein -5.54 N/A N/A N/A N/A
Nirmatrelvir Modify 3D_HE71 Genome polyprotein -7.64 N/A N/A N/A N/A
Nirmatrelvir 3D_HE71 Genome polyprotein -7.29 N/A N/A N/A N/A
Nirmatrelvir Modify 3D_HED68 Genome polyprotein -8.68 N/A N/A N/A N/A
Nirmatrelvir 3D_HED68 Genome polyprotein -7.96 N/A N/A N/A N/A
Nirmatrelvir Modify ACE2_HUMAN angiotensin converting enzyme 2 -10.85 N/A N/A 52.10% CHEMBL400526
Nirmatrelvir ACE2_HUMAN angiotensin converting enzyme 2 -9.40 N/A N/A 38.64% CHEMBL254900
Nirmatrelvir Modify CAPSD_9CALI Capsid protein -8.54 -7.92 -7.86 N/A N/A
Nirmatrelvir CAPSD_9CALI Capsid protein -7.25 -7.13 -7.40 N/A N/A
Nirmatrelvir Modify CAPSD_9ENTO Genome polyprotein -8.13 N/A N/A N/A N/A
Nirmatrelvir CAPSD_9ENTO Genome polyprotein -6.60 N/A N/A N/A N/A
Nirmatrelvir Modify CAPSD_DEN2P Genome polyprotein -7.28 N/A N/A N/A N/A
Nirmatrelvir CAPSD_DEN2P Genome polyprotein -6.63 N/A N/A N/A N/A
Nirmatrelvir Modify CAPSD_HCV77 Genome polyprotein -5.08 N/A N/A 45.76% CHEMBL296588
Nirmatrelvir CAPSD_HCV77 Genome polyprotein -4.50 N/A N/A 60.67% CHEMBL296588
Nirmatrelvir Modify CAPSD_HED68 Capsid protein VP0 -8.81 -9.91 N/A N/A N/A
Nirmatrelvir CAPSD_HED68 Capsid protein VP0 -7.87 -8.58 N/A N/A N/A
Nirmatrelvir Modify CAPSD_ZIKV Core protein -6.66 -7.34 N/A N/A N/A
Nirmatrelvir CAPSD_ZIKV Core protein -6.58 -5.76 N/A N/A N/A
Nirmatrelvir Modify DPM_HHV1K DNA polymerase catalytic subunit -8.11 N/A N/A 24.48% CHEMBL479371
Nirmatrelvir DPM_HHV1K DNA polymerase catalytic subunit -7.67 N/A N/A 16.31% CHEMBL479371
Nirmatrelvir Modify E1_9HEPC Envelope glycoprotein E1 -5.82 N/A N/A N/A N/A
Nirmatrelvir E1_9HEPC Envelope glycoprotein E1 -5.46 N/A N/A N/A N/A
Nirmatrelvir Modify E1_HCV77 Genome polyprotein -4.13 N/A N/A 45.76% CHEMBL296588
Nirmatrelvir E1_HCV77 Genome polyprotein -3.96 N/A N/A 60.67% CHEMBL296588
Nirmatrelvir Modify E1_HCVJ1 Genome polyprotein -4.50 N/A N/A N/A N/A
Nirmatrelvir E1_HCVJ1 Genome polyprotein -4.87 N/A N/A N/A N/A
Nirmatrelvir Modify E2_9HEPC Core protein precursor -8.05 N/A N/A N/A N/A
Nirmatrelvir E2_9HEPC Core protein precursor -8.00 N/A N/A N/A N/A
Nirmatrelvir Modify E2_HCV77 Genome polyprotein -6.43 N/A N/A 45.76% CHEMBL296588
Nirmatrelvir E2_HCV77 Genome polyprotein -6.10 N/A N/A 60.67% CHEMBL296588
Nirmatrelvir Modify ENV_9FLAV Envelope protein E -5.72 N/A N/A N/A N/A
Nirmatrelvir ENV_9FLAV Envelope protein E -4.91 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_DEN1B Genome polyprotein -5.50 N/A N/A N/A N/A
Nirmatrelvir ENV_DEN1B Genome polyprotein -5.64 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_DEN2P Genome polyprotein -7.75 N/A N/A N/A N/A
Nirmatrelvir ENV_DEN2P Genome polyprotein -6.76 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_DEN3P Genome polyprotein -6.51 N/A N/A N/A N/A
Nirmatrelvir ENV_DEN3P Genome polyprotein -5.42 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_HHV2H Envelope glycoprotein H -7.49 N/A N/A N/A N/A
Nirmatrelvir ENV_HHV2H Envelope glycoprotein H -6.30 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_ZIKV Core protein -6.28 N/A N/A N/A N/A
Nirmatrelvir ENV_ZIKV Core protein -5.71 N/A N/A N/A N/A
Nirmatrelvir Modify ENV_ZIKVK Genome polyprotein -6.31 N/A N/A N/A N/A
Nirmatrelvir ENV_ZIKVK Genome polyprotein -5.84 N/A N/A N/A N/A
Nirmatrelvir Modify G1_ADNV Envelope polyprotein -3.73 -7.10 -7.23 N/A N/A
Nirmatrelvir G1_ADNV Envelope polyprotein -3.58 -6.01 -6.16 N/A N/A
Nirmatrelvir Modify G2_ADNV Envelope polyprotein -8.89 -8.28 -7.55 N/A N/A
Nirmatrelvir G2_ADNV Envelope polyprotein -7.01 -7.23 -6.41 N/A N/A
Nirmatrelvir Modify GB_HHV11 Envelope glycoprotein B -8.09 N/A N/A N/A N/A
Nirmatrelvir GB_HHV11 Envelope glycoprotein B -6.84 N/A N/A N/A N/A
Nirmatrelvir Modify GB_HHV1K Envelope glycoprotein B -8.21 -8.26 N/A N/A N/A
Nirmatrelvir GB_HHV1K Envelope glycoprotein B -6.99 -7.22 N/A N/A N/A
Nirmatrelvir Modify GD_9ALPH Glycoprotein D -7.50 -6.06 N/A N/A N/A
Nirmatrelvir GD_9ALPH Glycoprotein D -6.93 -6.40 N/A N/A N/A
Nirmatrelvir Modify GD_HHV1 Glycoprotein D -7.19 N/A N/A N/A N/A
Nirmatrelvir GD_HHV1 Glycoprotein D -6.11 N/A N/A N/A N/A
Nirmatrelvir Modify GP160_HIV1 Envelope glycoprotein gp160 -6.79 -6.95 -7.29 N/A N/A
Nirmatrelvir GP160_HIV1 Envelope glycoprotein gp160 -6.83 -7.22 -7.33 N/A N/A
Nirmatrelvir Modify GP160_HIV2 Envelope glycoprotein gp160 -7.47 N/A N/A N/A N/A
Nirmatrelvir GP160_HIV2 Envelope glycoprotein gp160 -6.61 N/A N/A N/A N/A
Nirmatrelvir Modify GP_EBOV Envelope glycoprotein -7.48 -7.36 -7.63 38.36% CHEMBL3125895
Nirmatrelvir GP_EBOV Envelope glycoprotein -7.04 -7.03 -6.62 33.54% CHEMBL3125897
Nirmatrelvir Modify GP_LASSJ Pre-glycoprotein polyprotein GP complex -7.28 -6.39 N/A N/A N/A
Nirmatrelvir GP_LASSJ Pre-glycoprotein polyprotein GP complex -6.19 -5.96 N/A N/A N/A
Nirmatrelvir Modify HA_A-H10N7 Hemagglutinin -7.73 N/A N/A N/A N/A
Nirmatrelvir HA_A-H10N7 Hemagglutinin -7.42 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H10N8 Hemagglutinin -6.52 N/A N/A N/A N/A
Nirmatrelvir HA_A-H10N8 Hemagglutinin -6.38 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H13N6 Hemagglutinin -6.84 N/A N/A N/A N/A
Nirmatrelvir HA_A-H13N6 Hemagglutinin -6.11 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H14N6 Hemagglutinin -7.16 N/A N/A N/A N/A
Nirmatrelvir HA_A-H14N6 Hemagglutinin -6.93 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H15N9 Hemagglutinin -6.26 N/A N/A N/A N/A
Nirmatrelvir HA_A-H15N9 Hemagglutinin -6.73 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H17N10 Hemagglutinin -6.04 N/A N/A N/A N/A
Nirmatrelvir HA_A-H17N10 Hemagglutinin -6.19 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H18N11 Hemagglutinin -6.75 N/A N/A N/A N/A
Nirmatrelvir HA_A-H18N11 Hemagglutinin -5.98 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H1N1 Hemagglutinin -7.30 -6.99 N/A N/A N/A
Nirmatrelvir HA_A-H1N1 Hemagglutinin -6.41 -6.40 N/A N/A N/A
Nirmatrelvir Modify HA_A-H2N2 Hemagglutinin -6.75 -6.57 N/A N/A N/A
Nirmatrelvir HA_A-H2N2 Hemagglutinin -5.75 -6.48 N/A N/A N/A
Nirmatrelvir Modify HA_A-H3N2 Hemagglutinin -6.30 -6.49 -5.91 N/A N/A
Nirmatrelvir HA_A-H3N2 Hemagglutinin -6.99 -6.86 -6.67 N/A N/A
Nirmatrelvir Modify HA_A-H3N8 Hemagglutinin -6.48 -6.08 -6.88 N/A N/A
Nirmatrelvir HA_A-H3N8 Hemagglutinin -6.45 -6.26 -6.35 N/A N/A
Nirmatrelvir Modify HA_A-H5N1 Hemagglutinin -7.03 -7.35 -7.19 N/A N/A
Nirmatrelvir HA_A-H5N1 Hemagglutinin -6.22 -7.31 -6.88 N/A N/A
Nirmatrelvir Modify HA_A-H5N3 Hemagglutinin -6.93 -6.76 N/A N/A N/A
Nirmatrelvir HA_A-H5N3 Hemagglutinin -6.17 -6.47 N/A N/A N/A
Nirmatrelvir Modify HA_A-H6N1 Hemagglutinin -6.52 N/A N/A N/A N/A
Nirmatrelvir HA_A-H6N1 Hemagglutinin -6.38 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H6N6 Hemagglutinin -6.46 N/A N/A N/A N/A
Nirmatrelvir HA_A-H6N6 Hemagglutinin -6.57 N/A N/A N/A N/A
Nirmatrelvir Modify HA_A-H7N2 Hemagglutinin -6.49 -6.79 -6.53 N/A N/A
Nirmatrelvir HA_A-H7N2 Hemagglutinin -6.57 -5.66 -6.01 N/A N/A
Nirmatrelvir Modify HA_A-H7N7 Hemagglutinin -6.61 -7.54 N/A N/A N/A
Nirmatrelvir HA_A-H7N7 Hemagglutinin -6.50 -6.77 N/A N/A N/A
Nirmatrelvir Modify HA_A-H7N9 Hemagglutinin -7.03 N/A N/A N/A N/A
Nirmatrelvir HA_A-H7N9 Hemagglutinin -7.02 N/A N/A N/A N/A
Nirmatrelvir Modify HA_INFB Hemagglutinin -6.85 -6.50 N/A N/A N/A
Nirmatrelvir HA_INFB Hemagglutinin -5.95 -5.95 N/A N/A N/A
Nirmatrelvir Modify HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.81 N/A N/A N/A N/A
Nirmatrelvir HA_INFD Hemagglutinin-esterase-fusion glycoprotein -6.75 N/A N/A N/A N/A
Nirmatrelvir Modify HE_BCV Hemagglutinin-esterase -7.72 -7.17 N/A N/A N/A
Nirmatrelvir HE_BCV Hemagglutinin-esterase -6.56 -6.28 N/A N/A N/A
Nirmatrelvir Modify HE_HCoV-OC43 Hemagglutinin-esterase -5.87 N/A N/A N/A N/A
Nirmatrelvir HE_HCoV-OC43 Hemagglutinin-esterase -5.93 N/A N/A N/A N/A
Nirmatrelvir Modify HE_MHV Hemagglutinin-esterase -7.70 N/A N/A N/A N/A
Nirmatrelvir HE_MHV Hemagglutinin-esterase -5.90 N/A N/A N/A N/A
Nirmatrelvir Modify IN_HIV1 Gag-Pol polyprotein -6.24 -6.45 N/A N/A N/A
Nirmatrelvir IN_HIV1 Gag-Pol polyprotein -5.45 -5.77 N/A N/A N/A
Nirmatrelvir Modify MD_HKU4 Replicase polyprotein 1ab -8.70 -8.11 -7.91 N/A N/A
Nirmatrelvir MD_HKU4 Replicase polyprotein 1ab -8.90 -8.83 -7.56 N/A N/A
Nirmatrelvir Modify MD_MERs Replicase polyprotein 1a -8.50 -8.42 N/A N/A N/A
Nirmatrelvir MD_MERs Replicase polyprotein 1a -8.82 -7.06 N/A N/A N/A
Nirmatrelvir Modify MEM_9FLAV Core protein -5.64 N/A N/A N/A N/A
Nirmatrelvir MEM_9FLAV Core protein -6.04 N/A N/A N/A N/A
Nirmatrelvir Modify MTASE_SARS2 Methyltransferase -7.28 N/A N/A N/A N/A
Nirmatrelvir Modify MTASE_SARS2 Methyltransferase -8.16 N/A N/A N/A N/A
Nirmatrelvir MTASE_SARS2 Methyltransferase -6.49 N/A N/A N/A N/A
Nirmatrelvir MTASE_SARS2 Methyltransferase -7.89 N/A N/A N/A N/A
Nirmatrelvir Modify MX2_A-H5N1 Matrix protein 2 -1.91 N/A N/A N/A N/A
Nirmatrelvir MX2_A-H5N1 Matrix protein 2 -3.78 N/A N/A N/A N/A
Nirmatrelvir Modify MX_9MONO Matrix protein VP40 -9.23 N/A N/A N/A N/A
Nirmatrelvir MX_9MONO Matrix protein VP40 -7.87 N/A N/A N/A N/A
Nirmatrelvir Modify MX_LASSJ RING finger protein Z -5.83 N/A N/A N/A N/A
Nirmatrelvir MX_LASSJ RING finger protein Z -5.26 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H11N6 Neuraminidase -8.45 -8.17 -7.79 N/A N/A
Nirmatrelvir NA_A-H11N6 Neuraminidase -8.41 -8.20 -7.83 N/A N/A
Nirmatrelvir Modify NA_A-H11N9 Neuraminidase -6.67 -8.49 -8.11 N/A N/A
Nirmatrelvir NA_A-H11N9 Neuraminidase -5.59 -8.36 -8.06 N/A N/A
Nirmatrelvir Modify NA_A-H12N5 Neuraminidase -8.77 -7.91 -8.53 N/A N/A
Nirmatrelvir NA_A-H12N5 Neuraminidase -8.03 -8.04 -7.69 N/A N/A
Nirmatrelvir Modify NA_A-H13N9 Neuraminidase -6.40 N/A N/A N/A N/A
Nirmatrelvir NA_A-H13N9 Neuraminidase -6.40 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H17N10 Neuraminidase -7.57 N/A N/A N/A N/A
Nirmatrelvir NA_A-H17N10 Neuraminidase -7.40 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H18N11 Neuraminidase -7.31 N/A N/A N/A N/A
Nirmatrelvir NA_A-H18N11 Neuraminidase -7.06 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H1N1 Neuraminidase -8.26 N/A N/A N/A N/A
Nirmatrelvir NA_A-H1N1 Neuraminidase -8.12 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H2N2 Neuraminidase -8.20 -8.51 -7.90 N/A N/A
Nirmatrelvir NA_A-H2N2 Neuraminidase -8.02 -7.74 -7.38 N/A N/A
Nirmatrelvir Modify NA_A-H3N2 Ig heavy chain Mem5 -7.87 -8.31 N/A N/A N/A
Nirmatrelvir NA_A-H3N2 Ig heavy chain Mem5 -6.97 -7.40 N/A N/A N/A
Nirmatrelvir Modify NA_A-H3N8 Neuraminidase -8.30 -8.64 -8.24 34.83% CHEMBL4285767
Nirmatrelvir NA_A-H3N8 Neuraminidase -8.53 -8.51 -8.05 29.71% CHEMBL674
Nirmatrelvir Modify NA_A-H5N1 Neuraminidase -8.11 N/A N/A N/A N/A
Nirmatrelvir NA_A-H5N1 Neuraminidase -7.47 N/A N/A N/A N/A
Nirmatrelvir Modify NA_A-H7N9 Neuraminidase -7.96 -8.45 -7.88 N/A N/A
Nirmatrelvir NA_A-H7N9 Neuraminidase -7.93 -7.45 -8.29 N/A N/A
Nirmatrelvir Modify NA_INFB Neuraminidase -7.63 -8.05 N/A 45.70% CHEMBL362993
Nirmatrelvir NA_INFB Neuraminidase -7.27 -7.98 N/A 55.10% CHEMBL370047
Nirmatrelvir Modify NP_9ADNV Nucleoprotein -5.68 -8.27 N/A N/A N/A
Nirmatrelvir NP_9ADNV Nucleoprotein -5.14 -7.09 N/A N/A N/A
Nirmatrelvir Modify NP_A-H1N1 Nucleoprotein -7.35 -6.05 -6.51 N/A N/A
Nirmatrelvir NP_A-H1N1 Nucleoprotein -6.47 -6.10 -6.35 N/A N/A
Nirmatrelvir Modify NP_A-H5N1 Nucleoprotein -6.63 N/A N/A N/A N/A
Nirmatrelvir NP_A-H5N1 Nucleoprotein -6.05 N/A N/A N/A N/A
Nirmatrelvir Modify NP_EBOZM Nucleoprotein -6.92 -7.15 -7.73 N/A N/A
Nirmatrelvir NP_EBOZM Nucleoprotein -6.23 -6.12 -7.01 N/A N/A
Nirmatrelvir Modify NP_HCoV-NL63 Nucleoprotein -7.04 N/A N/A N/A N/A
Nirmatrelvir NP_HCoV-NL63 Nucleoprotein -6.46 N/A N/A N/A N/A
Nirmatrelvir Modify NP_HCoV-OC43 Nucleoprotein -8.01 -8.08 -7.46 18.71% CHEMBL3233481
Nirmatrelvir NP_HCoV-OC43 Nucleoprotein -8.25 -6.90 -6.77 15.25% CHEMBL3233481
Nirmatrelvir Modify NP_INFB Nucleoprotein -6.03 N/A N/A N/A N/A
Nirmatrelvir NP_INFB Nucleoprotein -6.08 N/A N/A N/A N/A
Nirmatrelvir Modify NP_INFD NP -5.08 N/A N/A N/A N/A
Nirmatrelvir NP_INFD NP -5.07 N/A N/A N/A N/A
Nirmatrelvir Modify NP_LASSJ Nucleoprotein -9.78 -9.98 -5.04 N/A N/A
Nirmatrelvir NP_LASSJ Nucleoprotein -9.13 -8.81 -5.12 N/A N/A
Nirmatrelvir Modify NP_SARS Nucleoprotein -7.86 N/A N/A N/A N/A
Nirmatrelvir NP_SARS Nucleoprotein -7.42 N/A N/A N/A N/A
Nirmatrelvir Modify NS1_9CALI NTPase -6.02 -5.13 -6.39 N/A N/A
Nirmatrelvir NS1_9CALI NTPase -5.43 -5.57 -6.15 N/A N/A
Nirmatrelvir Modify NS1_9FLAV Non-structural protein 1 -5.80 N/A N/A N/A N/A
Nirmatrelvir NS1_9FLAV Non-structural protein 1 -5.35 N/A N/A N/A N/A
Nirmatrelvir Modify NS1_DEN1W Genome polyprotein -6.62 N/A N/A N/A N/A
Nirmatrelvir NS1_DEN1W Genome polyprotein -5.47 N/A N/A N/A N/A
Nirmatrelvir Modify NS1_ZIKV Core protein 6.76 -6.37 -7.98 N/A N/A
Nirmatrelvir NS1_ZIKV Core protein 2.43 -6.46 -7.10 N/A N/A
Nirmatrelvir Modify NS2A_9FLAV Core protein -4.41 N/A N/A N/A N/A
Nirmatrelvir NS2A_9FLAV Core protein -4.48 N/A N/A N/A N/A
Nirmatrelvir Modify NS2B_DEN1W Genome polyprotein -7.43 N/A N/A N/A N/A
Nirmatrelvir NS2B_DEN1W Genome polyprotein -7.80 N/A N/A N/A N/A
Nirmatrelvir Modify NS2B_DEN2P Genome polyprotein -7.36 -7.57 N/A N/A N/A
Nirmatrelvir NS2B_DEN2P Genome polyprotein -6.52 -7.44 N/A N/A N/A
Nirmatrelvir Modify NS2B_ZIKV Genome polyprotein -7.27 -7.62 N/A N/A N/A
Nirmatrelvir NS2B_ZIKV Genome polyprotein -7.12 -7.38 N/A N/A N/A
Nirmatrelvir Modify NS2B_ZIKVF Genome polyprotein -7.50 N/A N/A N/A N/A
Nirmatrelvir NS2B_ZIKVF Genome polyprotein -6.97 N/A N/A N/A N/A
Nirmatrelvir Modify NS3_9FLAV Core protein -9.53 N/A N/A N/A N/A
Nirmatrelvir NS3_9FLAV Core protein -8.53 N/A N/A N/A N/A
Nirmatrelvir Modify NS3_DEN4T Genome polyprotein -8.94 -8.86 N/A N/A N/A
Nirmatrelvir NS3_DEN4T Genome polyprotein -7.64 -8.07 N/A N/A N/A
Nirmatrelvir Modify NS3_HCV1A Genome polyprotein -6.89 -7.12 -8.13 45.76% CHEMBL296588
Nirmatrelvir NS3_HCV1A Genome polyprotein -6.82 -5.96 -6.22 60.67% CHEMBL296588
Nirmatrelvir Modify NS3_HCV1B Genome polyprotein -7.58 -7.09 -6.39 41.43% CHEMBL3927196
Nirmatrelvir NS3_HCV1B Genome polyprotein -6.76 -6.80 -5.54 50.50% CHEMBL3921185
Nirmatrelvir Modify NS3_HCV3A Genome polyprotein -7.25 -7.35 -7.17 N/A N/A
Nirmatrelvir NS3_HCV3A Genome polyprotein -6.89 -6.30 -6.40 N/A N/A
Nirmatrelvir Modify NS3_ZIKV Genome polyprotein -8.37 N/A N/A N/A N/A
Nirmatrelvir NS3_ZIKV Genome polyprotein -8.41 N/A N/A N/A N/A
Nirmatrelvir Modify NS5B_HCV1A Genome polyprotein -8.20 -9.46 -9.43 51.63% CHEMBL68034
Nirmatrelvir NS5B_HCV1A Genome polyprotein -7.98 -8.13 -8.01 52.00% CHEMBL13443
Nirmatrelvir Modify NS5B_HCV1B Genome polyprotein -7.99 -7.57 -7.46 30.58% CHEMBL3645202
Nirmatrelvir NS5B_HCV1B Genome polyprotein -7.55 -7.93 -6.90 20.75% CHEMBL3422106
Nirmatrelvir Modify NS5B_HCV2A Genome polyprotein -8.58 -8.42 N/A 43.87% CHEMBL3127326
Nirmatrelvir NS5B_HCV2A Genome polyprotein -9.62 -6.16 N/A 34.72% CHEMBL3127326
Nirmatrelvir Modify NS5_9FLAV Core protein -8.90 N/A N/A N/A N/A
Nirmatrelvir NS5_9FLAV Core protein -8.58 N/A N/A N/A N/A
Nirmatrelvir Modify NS5_DEN3S Genome polyprotein -7.64 -8.35 N/A N/A N/A
Nirmatrelvir NS5_DEN3S Genome polyprotein -7.07 -8.26 N/A N/A N/A
Nirmatrelvir Modify NS5_ZIKV Genome polyprotein -8.47 -6.62 N/A N/A N/A
Nirmatrelvir NS5_ZIKV Genome polyprotein -8.03 -5.88 N/A N/A N/A
Nirmatrelvir Modify NS5_ZIKVF Genome polyprotein -8.73 N/A N/A N/A N/A
Nirmatrelvir NS5_ZIKVF Genome polyprotein -8.68 N/A N/A N/A N/A
Nirmatrelvir Modify NS6_9CALI NTPase -5.35 -5.97 -6.42 N/A N/A
Nirmatrelvir NS6_9CALI NTPase -5.19 -5.31 -6.29 N/A N/A
Nirmatrelvir Modify NSP15_SARS Replicase polyprotein 1ab -6.61 N/A N/A 63.36% CHEMBL2441741
Nirmatrelvir NSP15_SARS Replicase polyprotein 1ab -6.37 N/A N/A 42.31% CHEMBL2441741
Nirmatrelvir Modify NSP15_SARS2 Replicase polyprotein 1ab -6.58 N/A N/A N/A N/A
Nirmatrelvir NSP15_SARS2 Replicase polyprotein 1ab -6.49 N/A N/A N/A N/A
Nirmatrelvir Modify NSP1_INFB Non-structural protein 1 -6.90 -6.72 N/A N/A N/A
Nirmatrelvir NSP1_INFB Non-structural protein 1 -6.71 -6.37 N/A N/A N/A
Nirmatrelvir Modify NSP1_SARS Replicase polyprotein 1ab -6.40 N/A N/A 63.36% CHEMBL2441741
Nirmatrelvir NSP1_SARS Replicase polyprotein 1ab -6.15 N/A N/A 42.31% CHEMBL2441741
Nirmatrelvir Modify NSP3_HCoV-229E Replicase polyprotein 1a -9.27 N/A N/A N/A N/A
Nirmatrelvir NSP3_HCoV-229E Replicase polyprotein 1a -7.71 N/A N/A N/A N/A
Nirmatrelvir Modify NSP3_IBV Replicase polyprotein 1a -8.75 N/A N/A N/A N/A
Nirmatrelvir NSP3_IBV Replicase polyprotein 1a -7.06 N/A N/A N/A N/A
Nirmatrelvir Modify NSP3_MHV Replicase polyprotein 1ab -6.04 N/A N/A N/A N/A
Nirmatrelvir NSP3_MHV Replicase polyprotein 1ab -6.14 N/A N/A N/A N/A
Nirmatrelvir Modify NSP3_SARS2 Replicase polyprotein 1ab -8.23 N/A N/A N/A N/A
Nirmatrelvir NSP3_SARS2 Replicase polyprotein 1ab -7.45 N/A N/A N/A N/A
Nirmatrelvir Modify NSP9_HCoV-229E Replicase polyprotein 1ab -7.50 -6.88 N/A N/A N/A
Nirmatrelvir NSP9_HCoV-229E Replicase polyprotein 1ab -6.39 -6.81 N/A N/A N/A
Nirmatrelvir Modify PA_A-H17N10 Polymerase acidic protein -8.27 N/A N/A N/A N/A
Nirmatrelvir PA_A-H17N10 Polymerase acidic protein -7.62 N/A N/A N/A N/A
Nirmatrelvir Modify PA_A-H1N1 Polymerase acidic protein -9.64 -8.43 -8.20 N/A N/A
Nirmatrelvir PA_A-H1N1 Polymerase acidic protein -7.61 -7.57 -7.81 N/A N/A
Nirmatrelvir Modify PA_A-H5N1 Polymerase acidic protein -9.26 -8.65 -8.79 N/A N/A
Nirmatrelvir PA_A-H5N1 Polymerase acidic protein -7.81 -7.48 -7.56 N/A N/A
Nirmatrelvir Modify PA_INFA Polymerase acidic protein -8.52 -8.41 -8.44 36.96% CHEMBL2040554
Nirmatrelvir PA_INFA Polymerase acidic protein -8.22 -7.35 -7.70 24.03% CHEMBL2040554
Nirmatrelvir Modify PA_INFB Polymerase acidic protein -7.80 N/A N/A N/A N/A
Nirmatrelvir PA_INFB Polymerase acidic protein -7.39 N/A N/A N/A N/A
Nirmatrelvir Modify PB2_A-H3N2 Polymerase basic protein 2 -8.81 -8.15 N/A N/A N/A
Nirmatrelvir PB2_A-H3N2 Polymerase basic protein 2 -7.29 -7.64 N/A N/A N/A
Nirmatrelvir Modify PB2_A-H5N1 Polymerase basic protein 2 -8.34 -7.24 -7.37 N/A N/A
Nirmatrelvir PB2_A-H5N1 Polymerase basic protein 2 -7.64 -6.94 -7.42 N/A N/A
Nirmatrelvir Modify PB2_INFB Polymerase basic protein 2 -8.92 N/A N/A N/A N/A
Nirmatrelvir PB2_INFB Polymerase basic protein 2 -7.22 N/A N/A N/A N/A
Nirmatrelvir Modify PB3_A-H3N2 Polymerase basic protein 2 -8.28 N/A N/A N/A N/A
Nirmatrelvir PB3_A-H3N2 Polymerase basic protein 2 -7.79 N/A N/A N/A N/A
Nirmatrelvir Modify PB4_A-H3N2 Polymerase basic protein 2 -9.02 N/A N/A N/A N/A
Nirmatrelvir PB4_A-H3N2 Polymerase basic protein 2 -8.12 N/A N/A N/A N/A
Nirmatrelvir Modify PLP_SARS Replicase polyprotein 1a -9.36 -9.51 -9.08 45.03% CHEMBL213054
Nirmatrelvir PLP_SARS Replicase polyprotein 1a -7.34 -7.42 -8.27 42.86% CHEMBL213054
Nirmatrelvir Modify PLP_SARS2 papain-like protease -6.51 N/A N/A N/A N/A
Nirmatrelvir PLP_SARS2 papain-like protease -6.68 N/A N/A N/A N/A
Nirmatrelvir Modify PM_9VIRU RNA-directed RNA polymerase L -7.54 -8.20 N/A N/A N/A
Nirmatrelvir PM_9VIRU RNA-directed RNA polymerase L -7.20 -7.64 N/A N/A N/A
Nirmatrelvir Modify PR_FCoV Replicase polyprotein 1ab -8.66 N/A N/A 48.08% CHEMBL4214471
Nirmatrelvir PR_FCoV Replicase polyprotein 1ab -7.04 N/A N/A 52.83% CHEMBL4214066
Nirmatrelvir Modify PR_HCoV-229E Replicase polyprotein 1a -7.85 -7.80 N/A N/A N/A
Nirmatrelvir PR_HCoV-229E Replicase polyprotein 1a -7.67 -7.48 N/A N/A N/A
Nirmatrelvir Modify PR_HCoV-NL63 Replicase polyprotein 1a -4.18 -8.04 N/A N/A N/A
Nirmatrelvir PR_HCoV-NL63 Replicase polyprotein 1a -4.55 -7.50 N/A N/A N/A
Nirmatrelvir Modify PR_HIV1 Gag-Pol polyprotein -7.43 -8.09 -7.52 28.72% CHEMBL492666
Nirmatrelvir PR_HIV1 Gag-Pol polyprotein -6.46 -6.72 -7.03 17.03% CHEMBL492666
Nirmatrelvir Modify PR_HIV2 Gag-Pol polyprotein -7.50 -7.64 N/A N/A N/A
Nirmatrelvir PR_HIV2 Gag-Pol polyprotein -7.47 -6.82 N/A N/A N/A
Nirmatrelvir Modify PR_HKU1 Replicase polyprotein 1a -6.49 N/A N/A N/A N/A
Nirmatrelvir PR_HKU1 Replicase polyprotein 1a -6.35 N/A N/A N/A N/A
Nirmatrelvir Modify PR_HKU4 Replicase polyprotein 1ab -7.96 -7.43 -7.37 N/A N/A
Nirmatrelvir PR_HKU4 Replicase polyprotein 1ab -6.75 -7.19 -7.32 N/A N/A
Nirmatrelvir Modify PR_IBV Replicase polyprotein 1a -6.95 N/A N/A N/A N/A
Nirmatrelvir PR_IBV Replicase polyprotein 1a -6.96 N/A N/A N/A N/A
Nirmatrelvir Modify PR_MERs 3C-like proteinase -7.20 -8.51 N/A N/A N/A
Nirmatrelvir PR_MERs 3C-like proteinase -7.55 -8.02 N/A N/A N/A
Nirmatrelvir Modify PR_PEDV 3C-like proteinase -8.07 N/A N/A N/A N/A
Nirmatrelvir PR_PEDV 3C-like proteinase -7.85 N/A N/A N/A N/A
Nirmatrelvir Modify PR_SARS Replicase polyprotein 1ab -8.09 -7.75 -7.44 63.36% CHEMBL2441741
Nirmatrelvir PR_SARS Replicase polyprotein 1ab -6.87 -7.34 -7.32 42.31% CHEMBL2441741
Nirmatrelvir Modify PR_SARS2 3C-like protease -7.74 N/A N/A N/A N/A
Nirmatrelvir PR_SARS2 3C-like protease -6.88 N/A N/A N/A N/A
Nirmatrelvir Modify PR_TGEV Replicase polyprotein 1a -6.85 N/A N/A N/A N/A
Nirmatrelvir PR_TGEV Replicase polyprotein 1a -6.94 N/A N/A N/A N/A
Nirmatrelvir Modify P_9CALI Norovirus P domain protein -8.01 N/A N/A N/A N/A
Nirmatrelvir P_9CALI Norovirus P domain protein -7.87 N/A N/A N/A N/A
Nirmatrelvir Modify P_NVN68 Capsid protein VP1 -7.25 N/A N/A N/A N/A
Nirmatrelvir P_NVN68 Capsid protein VP1 -5.30 N/A N/A N/A N/A
Nirmatrelvir Modify RDRP_SARS2 RNA-dependent RNA polymerase -7.16 N/A N/A 16.56% CHEMBL4065616
Nirmatrelvir RDRP_SARS2 RNA-dependent RNA polymerase -6.54 N/A N/A 10.37% CHEMBL4065616
Nirmatrelvir Modify RT_HIV1 Gag-Pol polyprotein -9.33 -9.54 -9.75 47.37% CHEMBL3683703
Nirmatrelvir RT_HIV1 Gag-Pol polyprotein -8.05 -8.30 -7.19 33.58% CHEMBL4225865
Nirmatrelvir Modify SPIKE_HCoV-229E Spike glycoprotein -5.65 N/A N/A N/A N/A
Nirmatrelvir SPIKE_HCoV-229E Spike glycoprotein -4.66 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_HCoV-NL63 Spike glycoprotein -5.84 N/A N/A N/A N/A
Nirmatrelvir SPIKE_HCoV-NL63 Spike glycoprotein -6.20 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_HCoV-OC43 Spike glycoprotein -6.93 N/A N/A N/A N/A
Nirmatrelvir SPIKE_HCoV-OC43 Spike glycoprotein -6.36 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_HKU4 Spike glycoprotein -7.28 N/A N/A N/A N/A
Nirmatrelvir SPIKE_HKU4 Spike glycoprotein -7.03 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_IBV Spike glycoprotein -6.95 N/A N/A N/A N/A
Nirmatrelvir SPIKE_IBV Spike glycoprotein -6.39 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_MERs Spike glycoprotein -7.80 -7.06 -6.40 N/A N/A
Nirmatrelvir SPIKE_MERs Spike glycoprotein -7.21 -6.20 -5.53 N/A N/A
Nirmatrelvir Modify SPIKE_MHV Spike glycoprotein -7.60 N/A N/A N/A N/A
Nirmatrelvir SPIKE_MHV Spike glycoprotein -7.29 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_PDCoV Spike protein -7.14 N/A N/A N/A N/A
Nirmatrelvir SPIKE_PDCoV Spike protein -6.85 N/A N/A N/A N/A
Nirmatrelvir Modify SPIKE_SARS Spike glycoprotein -6.79 -7.12 N/A N/A N/A
Nirmatrelvir SPIKE_SARS Spike glycoprotein -6.27 -6.61 N/A N/A N/A
Nirmatrelvir Modify SPIKE_SARS2 Spike glycoprotein -6.73 -6.96 -7.06 N/A N/A
Nirmatrelvir SPIKE_SARS2 Spike glycoprotein -5.64 -6.37 -7.36 N/A N/A
Nirmatrelvir Modify VP1_9CALI Capsid protein -8.04 N/A N/A N/A N/A
Nirmatrelvir VP1_9CALI Capsid protein -7.36 N/A N/A N/A N/A
Nirmatrelvir Modify VP1_NVN68 Capsid protein VP1 -6.11 N/A N/A N/A N/A
Nirmatrelvir VP1_NVN68 Capsid protein VP1 -5.76 N/A N/A N/A N/A
Nirmatrelvir Modify VP24_EBORE Membrane-associated protein VP24 -5.81 N/A N/A N/A N/A
Nirmatrelvir VP24_EBORE Membrane-associated protein VP24 -5.21 N/A N/A N/A N/A
Nirmatrelvir Modify VP24_EBOSU Membrane-associated protein VP24 -5.85 N/A N/A N/A N/A
Nirmatrelvir VP24_EBOSU Membrane-associated protein VP24 -5.09 N/A N/A N/A N/A
Nirmatrelvir Modify VP24_EBOZM Membrane-associated protein VP24 -5.99 N/A N/A N/A N/A
Nirmatrelvir VP24_EBOZM Membrane-associated protein VP24 -5.73 N/A N/A N/A N/A
Nirmatrelvir Modify VP30_9MONO Minor nucleoprotein VP30 -7.19 N/A N/A N/A N/A
Nirmatrelvir VP30_9MONO Minor nucleoprotein VP30 -5.64 N/A N/A N/A N/A
Nirmatrelvir Modify VP30_EBOZ5 Transcriptional activator VP30 -7.05 N/A N/A N/A N/A
Nirmatrelvir VP30_EBOZ5 Transcriptional activator VP30 -6.00 N/A N/A N/A N/A
Nirmatrelvir Modify VP30_EBOZM Transcriptional activator VP30 -7.49 N/A N/A N/A N/A
Nirmatrelvir VP30_EBOZM Transcriptional activator VP30 -6.81 N/A N/A N/A N/A
Nirmatrelvir Modify VP35_EBORR Polymerase cofactor VP35 -6.84 N/A N/A N/A N/A
Nirmatrelvir VP35_EBORR Polymerase cofactor VP35 -5.49 N/A N/A N/A N/A
Nirmatrelvir Modify VP35_EBOZM Polymerase cofactor VP35 -6.79 -7.09 -7.56 N/A N/A
Nirmatrelvir VP35_EBOZM Polymerase cofactor VP35 -5.91 -5.85 -6.47 N/A N/A
Nirmatrelvir Modify VP40_EBOZM Matrix protein VP40 -5.87 -6.11 N/A N/A N/A
Nirmatrelvir VP40_EBOZM Matrix protein VP40 -5.16 -5.73 N/A N/A N/A