Ligand | Protein Symbol | Approved Name | Docking Scores |
Similarity Score |
Best Match | ||
---|---|---|---|---|---|---|---|
Model 1 | Model 2 | Model 3 | |||||
ma | 2A_HE71 | Genome polyprotein | -5.60 | N/A | N/A | N/A | N/A |
mb | 2A_HE71 | Genome polyprotein | -6.34 | N/A | N/A | N/A | N/A |
ma | 2A_HE71M | Genome polyprotein | -5.58 | N/A | N/A | N/A | N/A |
mb | 2A_HE71M | Genome polyprotein | -6.34 | N/A | N/A | N/A | N/A |
ma | 2C_HE71 | Genome polyprotein | -4.74 | -4.82 | N/A | N/A | N/A |
mb | 2C_HE71 | Genome polyprotein | -4.53 | -5.44 | N/A | N/A | N/A |
ma | 3A_9ENTO | Genome polyprotein | -4.71 | N/A | N/A | N/A | N/A |
mb | 3A_9ENTO | Genome polyprotein | -4.82 | N/A | N/A | N/A | N/A |
ma | 3A_HE71M | Genome polyprotein | -4.11 | N/A | N/A | N/A | N/A |
mb | 3A_HE71M | Genome polyprotein | -4.43 | N/A | N/A | N/A | N/A |
ma | 3A_HED68 | Genome polyprotein | -4.31 | N/A | N/A | N/A | N/A |
mb | 3A_HED68 | Genome polyprotein | -4.58 | N/A | N/A | N/A | N/A |
ma | 3C_HE71 | Genome polyprotein | -4.19 | -5.17 | N/A | N/A | N/A |
mb | 3C_HE71 | Genome polyprotein | -4.59 | -5.48 | N/A | N/A | N/A |
ma | 3C_HED68 | Genome polyprotein | -4.59 | N/A | N/A | N/A | N/A |
mb | 3C_HED68 | Genome polyprotein | -4.90 | N/A | N/A | N/A | N/A |
ma | 3D_HE71 | Genome polyprotein | -5.49 | N/A | N/A | N/A | N/A |
mb | 3D_HE71 | Genome polyprotein | -5.88 | N/A | N/A | N/A | N/A |
ma | 3D_HED68 | Genome polyprotein | -5.73 | N/A | N/A | N/A | N/A |
mb | 3D_HED68 | Genome polyprotein | -6.14 | N/A | N/A | N/A | N/A |
ma | ACE2_HUMAN | angiotensin converting enzyme 2 | -5.81 | N/A | N/A | 28.12% | CHEMBL253224 |
mb | ACE2_HUMAN | angiotensin converting enzyme 2 | -6.62 | N/A | N/A | 27.72% | CHEMBL253224 |
ma | CAPSD_9CALI | Capsid protein | -5.64 | -6.19 | -5.44 | N/A | N/A |
mb | CAPSD_9CALI | Capsid protein | -5.44 | -7.36 | -5.99 | N/A | N/A |
ma | CAPSD_9ENTO | Genome polyprotein | -6.39 | N/A | N/A | N/A | N/A |
mb | CAPSD_9ENTO | Genome polyprotein | -7.54 | N/A | N/A | N/A | N/A |
ma | CAPSD_DEN2P | Genome polyprotein | -4.60 | N/A | N/A | N/A | N/A |
mb | CAPSD_DEN2P | Genome polyprotein | -5.03 | N/A | N/A | N/A | N/A |
ma | CAPSD_HCV77 | Genome polyprotein | -3.65 | N/A | N/A | 37.78% | CHEMBL4107993 |
mb | CAPSD_HCV77 | Genome polyprotein | -3.90 | N/A | N/A | 42.86% | CHEMBL4107993 |
ma | CAPSD_HED68 | Capsid protein VP0 | -5.67 | -5.81 | N/A | N/A | N/A |
mb | CAPSD_HED68 | Capsid protein VP0 | -6.28 | -6.63 | N/A | N/A | N/A |
ma | CAPSD_ZIKV | Core protein | -4.58 | -4.50 | N/A | N/A | N/A |
mb | CAPSD_ZIKV | Core protein | -4.75 | -4.88 | N/A | N/A | N/A |
ma | DPM_HHV1K | DNA polymerase catalytic subunit | -5.86 | N/A | N/A | 13.30% | CHEMBL481172 |
mb | DPM_HHV1K | DNA polymerase catalytic subunit | -6.84 | N/A | N/A | 14.15% | CHEMBL479371 |
ma | E1_9HEPC | Envelope glycoprotein E1 | -4.72 | N/A | N/A | N/A | N/A |
mb | E1_9HEPC | Envelope glycoprotein E1 | -4.42 | N/A | N/A | N/A | N/A |
ma | E1_HCV77 | Genome polyprotein | -3.51 | N/A | N/A | 37.78% | CHEMBL4107993 |
mb | E1_HCV77 | Genome polyprotein | -3.57 | N/A | N/A | 42.86% | CHEMBL4107993 |
ma | E1_HCVJ1 | Genome polyprotein | -4.06 | N/A | N/A | N/A | N/A |
mb | E1_HCVJ1 | Genome polyprotein | -3.91 | N/A | N/A | N/A | N/A |
ma | E2_9HEPC | Core protein precursor | -6.71 | N/A | N/A | N/A | N/A |
mb | E2_9HEPC | Core protein precursor | -6.14 | N/A | N/A | N/A | N/A |
ma | E2_HCV77 | Genome polyprotein | -4.40 | N/A | N/A | 37.78% | CHEMBL4107993 |
mb | E2_HCV77 | Genome polyprotein | -4.90 | N/A | N/A | 42.86% | CHEMBL4107993 |
ma | ENV_9FLAV | Envelope protein E | -4.14 | N/A | N/A | N/A | N/A |
mb | ENV_9FLAV | Envelope protein E | -4.41 | N/A | N/A | N/A | N/A |
ma | ENV_DEN1B | Genome polyprotein | -4.80 | N/A | N/A | N/A | N/A |
mb | ENV_DEN1B | Genome polyprotein | -4.60 | N/A | N/A | N/A | N/A |
ma | ENV_DEN2P | Genome polyprotein | -5.15 | N/A | N/A | N/A | N/A |
mb | ENV_DEN2P | Genome polyprotein | -5.29 | N/A | N/A | N/A | N/A |
ma | ENV_DEN3P | Genome polyprotein | -4.90 | N/A | N/A | N/A | N/A |
mb | ENV_DEN3P | Genome polyprotein | -5.26 | N/A | N/A | N/A | N/A |
ma | ENV_HHV2H | Envelope glycoprotein H | -5.41 | N/A | N/A | N/A | N/A |
mb | ENV_HHV2H | Envelope glycoprotein H | -5.67 | N/A | N/A | N/A | N/A |
ma | ENV_ZIKV | Core protein | -4.58 | N/A | N/A | N/A | N/A |
mb | ENV_ZIKV | Core protein | -5.08 | N/A | N/A | N/A | N/A |
ma | ENV_ZIKVK | Genome polyprotein | -5.55 | N/A | N/A | N/A | N/A |
mb | ENV_ZIKVK | Genome polyprotein | -5.15 | N/A | N/A | N/A | N/A |
ma | G1_ADNV | Envelope polyprotein | -3.72 | -5.32 | -5.14 | N/A | N/A |
mb | G1_ADNV | Envelope polyprotein | -3.68 | -5.48 | -5.45 | N/A | N/A |
ma | G2_ADNV | Envelope polyprotein | -6.41 | -6.21 | -4.73 | N/A | N/A |
mb | G2_ADNV | Envelope polyprotein | -7.00 | -6.63 | -5.25 | N/A | N/A |
ma | GB_HHV11 | Envelope glycoprotein B | -5.32 | N/A | N/A | N/A | N/A |
mb | GB_HHV11 | Envelope glycoprotein B | -5.49 | N/A | N/A | N/A | N/A |
ma | GB_HHV1K | Envelope glycoprotein B | -5.59 | -5.67 | N/A | N/A | N/A |
mb | GB_HHV1K | Envelope glycoprotein B | -6.14 | -5.81 | N/A | N/A | N/A |
ma | GD_9ALPH | Glycoprotein D | -5.40 | -4.94 | N/A | N/A | N/A |
mb | GD_9ALPH | Glycoprotein D | -5.87 | -4.57 | N/A | N/A | N/A |
ma | GD_HHV1 | Glycoprotein D | -5.20 | N/A | N/A | N/A | N/A |
mb | GD_HHV1 | Glycoprotein D | -5.30 | N/A | N/A | N/A | N/A |
ma | GP160_HIV1 | Envelope glycoprotein gp160 | -6.58 | -6.68 | -6.10 | N/A | N/A |
mb | GP160_HIV1 | Envelope glycoprotein gp160 | -5.41 | -5.04 | -4.93 | N/A | N/A |
ma | GP160_HIV2 | Envelope glycoprotein gp160 | -5.60 | N/A | N/A | N/A | N/A |
mb | GP160_HIV2 | Envelope glycoprotein gp160 | -5.79 | N/A | N/A | N/A | N/A |
ma | GP_EBOV | Envelope glycoprotein | -5.54 | -4.61 | -4.54 | 27.47% | CHEMBL1655 |
mb | GP_EBOV | Envelope glycoprotein | -6.21 | -5.42 | -5.17 | 27.08% | CHEMBL1655 |
ma | GP_LASSJ | Pre-glycoprotein polyprotein GP complex | -5.11 | -5.35 | N/A | N/A | N/A |
mb | GP_LASSJ | Pre-glycoprotein polyprotein GP complex | -5.68 | -5.98 | N/A | N/A | N/A |
ma | HA_A-H10N7 | Hemagglutinin | -4.90 | N/A | N/A | N/A | N/A |
mb | HA_A-H10N7 | Hemagglutinin | -5.18 | N/A | N/A | N/A | N/A |
ma | HA_A-H10N8 | Hemagglutinin | -4.06 | N/A | N/A | N/A | N/A |
mb | HA_A-H10N8 | Hemagglutinin | -4.52 | N/A | N/A | N/A | N/A |
ma | HA_A-H13N6 | Hemagglutinin | -4.87 | N/A | N/A | N/A | N/A |
mb | HA_A-H13N6 | Hemagglutinin | -5.04 | N/A | N/A | N/A | N/A |
ma | HA_A-H14N6 | Hemagglutinin | -4.60 | N/A | N/A | N/A | N/A |
mb | HA_A-H14N6 | Hemagglutinin | -5.06 | N/A | N/A | N/A | N/A |
ma | HA_A-H15N9 | Hemagglutinin | -5.19 | N/A | N/A | N/A | N/A |
mb | HA_A-H15N9 | Hemagglutinin | -4.99 | N/A | N/A | N/A | N/A |
ma | HA_A-H17N10 | Hemagglutinin | -4.43 | N/A | N/A | N/A | N/A |
mb | HA_A-H17N10 | Hemagglutinin | -5.07 | N/A | N/A | N/A | N/A |
ma | HA_A-H18N11 | Hemagglutinin | -4.64 | N/A | N/A | N/A | N/A |
mb | HA_A-H18N11 | Hemagglutinin | -4.77 | N/A | N/A | N/A | N/A |
ma | HA_A-H1N1 | Hemagglutinin | -5.16 | -4.51 | N/A | N/A | N/A |
mb | HA_A-H1N1 | Hemagglutinin | -5.02 | -4.67 | N/A | N/A | N/A |
ma | HA_A-H2N2 | Hemagglutinin | -5.39 | -5.55 | N/A | N/A | N/A |
mb | HA_A-H2N2 | Hemagglutinin | -6.01 | -6.01 | N/A | N/A | N/A |
ma | HA_A-H3N2 | Hemagglutinin | -5.32 | -5.15 | -4.62 | N/A | N/A |
mb | HA_A-H3N2 | Hemagglutinin | -5.38 | -4.91 | -4.99 | N/A | N/A |
ma | HA_A-H3N8 | Hemagglutinin | -4.04 | -4.50 | -4.26 | N/A | N/A |
mb | HA_A-H3N8 | Hemagglutinin | -4.52 | -4.72 | -4.71 | N/A | N/A |
ma | HA_A-H5N1 | Hemagglutinin | -5.93 | -5.30 | -6.38 | N/A | N/A |
mb | HA_A-H5N1 | Hemagglutinin | -5.60 | -5.28 | -5.23 | N/A | N/A |
ma | HA_A-H5N3 | Hemagglutinin | -4.87 | -6.03 | N/A | N/A | N/A |
mb | HA_A-H5N3 | Hemagglutinin | -5.45 | -4.96 | N/A | N/A | N/A |
ma | HA_A-H6N1 | Hemagglutinin | -4.06 | N/A | N/A | N/A | N/A |
mb | HA_A-H6N1 | Hemagglutinin | -4.52 | N/A | N/A | N/A | N/A |
ma | HA_A-H6N6 | Hemagglutinin | -4.70 | N/A | N/A | N/A | N/A |
mb | HA_A-H6N6 | Hemagglutinin | -4.96 | N/A | N/A | N/A | N/A |
ma | HA_A-H7N2 | Hemagglutinin | -4.50 | -4.42 | -4.86 | N/A | N/A |
mb | HA_A-H7N2 | Hemagglutinin | -4.70 | -4.82 | -4.59 | N/A | N/A |
ma | HA_A-H7N7 | Hemagglutinin | -4.55 | -5.31 | N/A | N/A | N/A |
mb | HA_A-H7N7 | Hemagglutinin | -4.87 | -5.45 | N/A | N/A | N/A |
ma | HA_A-H7N9 | Hemagglutinin | -5.49 | N/A | N/A | N/A | N/A |
mb | HA_A-H7N9 | Hemagglutinin | -5.22 | N/A | N/A | N/A | N/A |
ma | HA_INFB | Hemagglutinin | -4.91 | -4.98 | N/A | N/A | N/A |
mb | HA_INFB | Hemagglutinin | -5.26 | -5.10 | N/A | N/A | N/A |
ma | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -4.28 | N/A | N/A | N/A | N/A |
mb | HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -4.58 | N/A | N/A | N/A | N/A |
ma | HE_BCV | Hemagglutinin-esterase | -6.01 | -5.51 | N/A | N/A | N/A |
mb | HE_BCV | Hemagglutinin-esterase | -5.70 | -5.02 | N/A | N/A | N/A |
ma | HE_HCoV-OC43 | Hemagglutinin-esterase | -4.41 | N/A | N/A | N/A | N/A |
mb | HE_HCoV-OC43 | Hemagglutinin-esterase | -5.12 | N/A | N/A | N/A | N/A |
ma | HE_MHV | Hemagglutinin-esterase | -4.81 | N/A | N/A | N/A | N/A |
mb | HE_MHV | Hemagglutinin-esterase | -5.39 | N/A | N/A | N/A | N/A |
ma | IN_HIV1 | Gag-Pol polyprotein | -3.86 | -3.81 | N/A | N/A | N/A |
mb | IN_HIV1 | Gag-Pol polyprotein | -3.97 | -4.31 | N/A | N/A | N/A |
ma | MD_HKU4 | Replicase polyprotein 1ab | -5.86 | -6.03 | -5.91 | N/A | N/A |
mb | MD_HKU4 | Replicase polyprotein 1ab | -7.03 | -6.81 | -6.77 | N/A | N/A |
ma | MD_MERs | Replicase polyprotein 1a | -6.12 | -6.25 | N/A | N/A | N/A |
mb | MD_MERs | Replicase polyprotein 1a | -6.97 | -6.37 | N/A | N/A | N/A |
ma | MEM_9FLAV | Core protein | -4.00 | N/A | N/A | N/A | N/A |
mb | MEM_9FLAV | Core protein | -4.56 | N/A | N/A | N/A | N/A |
ma | MTASE_SARS2 | Methyltransferase | -5.44 | N/A | N/A | N/A | N/A |
ma | MTASE_SARS2 | Methyltransferase | -5.70 | N/A | N/A | N/A | N/A |
mb | MTASE_SARS2 | Methyltransferase | -5.60 | N/A | N/A | N/A | N/A |
mb | MTASE_SARS2 | Methyltransferase | -6.04 | N/A | N/A | N/A | N/A |
ma | MX2_A-H5N1 | Matrix protein 2 | -6.55 | N/A | N/A | N/A | N/A |
mb | MX2_A-H5N1 | Matrix protein 2 | -7.35 | N/A | N/A | N/A | N/A |
ma | MX_9MONO | Matrix protein VP40 | -5.53 | N/A | N/A | N/A | N/A |
mb | MX_9MONO | Matrix protein VP40 | -6.00 | N/A | N/A | N/A | N/A |
ma | MX_LASSJ | RING finger protein Z | -4.83 | N/A | N/A | N/A | N/A |
mb | MX_LASSJ | RING finger protein Z | -5.35 | N/A | N/A | N/A | N/A |
ma | NA_A-H11N6 | Neuraminidase | -5.86 | -5.80 | -5.82 | N/A | N/A |
mb | NA_A-H11N6 | Neuraminidase | -6.45 | -6.49 | -6.22 | N/A | N/A |
ma | NA_A-H11N9 | Neuraminidase | -4.86 | -5.75 | -5.91 | N/A | N/A |
mb | NA_A-H11N9 | Neuraminidase | -6.34 | -6.28 | -6.31 | N/A | N/A |
ma | NA_A-H12N5 | Neuraminidase | -5.67 | -5.71 | -5.68 | N/A | N/A |
mb | NA_A-H12N5 | Neuraminidase | -6.21 | -6.41 | -6.30 | N/A | N/A |
ma | NA_A-H13N9 | Neuraminidase | -5.11 | N/A | N/A | N/A | N/A |
mb | NA_A-H13N9 | Neuraminidase | -5.42 | N/A | N/A | N/A | N/A |
ma | NA_A-H17N10 | Neuraminidase | -4.89 | N/A | N/A | N/A | N/A |
mb | NA_A-H17N10 | Neuraminidase | -5.63 | N/A | N/A | N/A | N/A |
ma | NA_A-H18N11 | Neuraminidase | -4.49 | N/A | N/A | N/A | N/A |
mb | NA_A-H18N11 | Neuraminidase | -5.13 | N/A | N/A | N/A | N/A |
ma | NA_A-H1N1 | Neuraminidase | -5.71 | N/A | N/A | N/A | N/A |
mb | NA_A-H1N1 | Neuraminidase | -6.22 | N/A | N/A | N/A | N/A |
ma | NA_A-H2N2 | Neuraminidase | -5.70 | -6.06 | -5.54 | N/A | N/A |
mb | NA_A-H2N2 | Neuraminidase | -6.33 | -6.24 | -6.15 | N/A | N/A |
ma | NA_A-H3N2 | Ig heavy chain Mem5 | -5.31 | -5.19 | N/A | N/A | N/A |
mb | NA_A-H3N2 | Ig heavy chain Mem5 | -5.91 | -6.09 | N/A | N/A | N/A |
ma | NA_A-H3N8 | Neuraminidase | -5.39 | -6.24 | -5.64 | 14.29% | CHEMBL4285767 |
mb | NA_A-H3N8 | Neuraminidase | -6.26 | -6.13 | -6.36 | 14.47% | CHEMBL4285767 |
ma | NA_A-H5N1 | Neuraminidase | -5.73 | N/A | N/A | N/A | N/A |
mb | NA_A-H5N1 | Neuraminidase | -5.96 | N/A | N/A | N/A | N/A |
ma | NA_A-H7N9 | Neuraminidase | -5.71 | -5.82 | -5.73 | N/A | N/A |
mb | NA_A-H7N9 | Neuraminidase | -6.11 | -6.34 | -6.16 | N/A | N/A |
ma | NA_INFB | Neuraminidase | -5.62 | -5.93 | N/A | 16.20% | CHEMBL81286 |
mb | NA_INFB | Neuraminidase | -6.06 | -6.27 | N/A | 16.33% | CHEMBL81286 |
ma | NP_9ADNV | Nucleoprotein | -3.88 | -6.01 | N/A | N/A | N/A |
mb | NP_9ADNV | Nucleoprotein | -3.98 | -6.11 | N/A | N/A | N/A |
ma | NP_A-H1N1 | Nucleoprotein | -4.66 | -5.17 | -5.42 | N/A | N/A |
mb | NP_A-H1N1 | Nucleoprotein | -4.97 | -4.89 | -5.64 | N/A | N/A |
ma | NP_A-H5N1 | Nucleoprotein | -5.46 | N/A | N/A | N/A | N/A |
mb | NP_A-H5N1 | Nucleoprotein | -5.81 | N/A | N/A | N/A | N/A |
ma | NP_EBOZM | Nucleoprotein | -4.66 | -4.77 | -4.65 | N/A | N/A |
mb | NP_EBOZM | Nucleoprotein | -5.08 | -5.30 | -5.29 | N/A | N/A |
ma | NP_HCoV-NL63 | Nucleoprotein | -4.88 | N/A | N/A | N/A | N/A |
mb | NP_HCoV-NL63 | Nucleoprotein | -5.60 | N/A | N/A | N/A | N/A |
ma | NP_HCoV-OC43 | Nucleoprotein | -6.33 | -6.43 | -5.76 | 9.78% | CHEMBL3233481 |
mb | NP_HCoV-OC43 | Nucleoprotein | -6.95 | -6.46 | -5.76 | 10.31% | CHEMBL3233481 |
ma | NP_INFB | Nucleoprotein | -4.24 | N/A | N/A | N/A | N/A |
mb | NP_INFB | Nucleoprotein | -4.33 | N/A | N/A | N/A | N/A |
ma | NP_INFD | NP | -4.15 | N/A | N/A | N/A | N/A |
mb | NP_INFD | NP | -4.38 | N/A | N/A | N/A | N/A |
ma | NP_LASSJ | Nucleoprotein | -6.42 | -6.51 | -3.51 | N/A | N/A |
mb | NP_LASSJ | Nucleoprotein | -7.23 | -7.31 | -4.16 | N/A | N/A |
ma | NP_SARS | Nucleoprotein | -5.42 | N/A | N/A | N/A | N/A |
mb | NP_SARS | Nucleoprotein | -5.55 | N/A | N/A | N/A | N/A |
ma | NS1_9CALI | NTPase | -4.92 | -4.23 | -4.77 | N/A | N/A |
mb | NS1_9CALI | NTPase | -4.84 | -4.69 | -4.89 | N/A | N/A |
ma | NS1_9FLAV | Non-structural protein 1 | -5.18 | N/A | N/A | N/A | N/A |
mb | NS1_9FLAV | Non-structural protein 1 | -4.94 | N/A | N/A | N/A | N/A |
ma | NS1_DEN1W | Genome polyprotein | -4.57 | N/A | N/A | N/A | N/A |
mb | NS1_DEN1W | Genome polyprotein | -5.10 | N/A | N/A | N/A | N/A |
ma | NS1_ZIKV | Core protein | -6.28 | -5.80 | -5.20 | N/A | N/A |
mb | NS1_ZIKV | Core protein | -7.22 | -6.42 | -5.56 | N/A | N/A |
ma | NS2A_9FLAV | Core protein | -3.20 | N/A | N/A | N/A | N/A |
mb | NS2A_9FLAV | Core protein | -3.55 | N/A | N/A | N/A | N/A |
ma | NS2B_DEN1W | Genome polyprotein | -5.09 | N/A | N/A | N/A | N/A |
mb | NS2B_DEN1W | Genome polyprotein | -5.33 | N/A | N/A | N/A | N/A |
ma | NS2B_DEN2P | Genome polyprotein | -5.33 | -5.39 | N/A | N/A | N/A |
mb | NS2B_DEN2P | Genome polyprotein | -5.68 | -5.73 | N/A | N/A | N/A |
ma | NS2B_ZIKV | Genome polyprotein | -5.54 | -5.23 | N/A | N/A | N/A |
mb | NS2B_ZIKV | Genome polyprotein | -5.74 | -5.69 | N/A | N/A | N/A |
ma | NS2B_ZIKVF | Genome polyprotein | -5.01 | N/A | N/A | N/A | N/A |
mb | NS2B_ZIKVF | Genome polyprotein | -5.47 | N/A | N/A | N/A | N/A |
ma | NS3_9FLAV | Core protein | -5.75 | N/A | N/A | N/A | N/A |
mb | NS3_9FLAV | Core protein | -5.82 | N/A | N/A | N/A | N/A |
ma | NS3_DEN4T | Genome polyprotein | -5.94 | -5.38 | N/A | N/A | N/A |
mb | NS3_DEN4T | Genome polyprotein | -6.26 | -5.86 | N/A | N/A | N/A |
ma | NS3_HCV1A | Genome polyprotein | -5.65 | -5.04 | -5.33 | 37.78% | CHEMBL4107993 |
mb | NS3_HCV1A | Genome polyprotein | -5.92 | -5.57 | -6.16 | 42.86% | CHEMBL4107993 |
ma | NS3_HCV1B | Genome polyprotein | -5.35 | -5.15 | -5.20 | 13.82% | CHEMBL1170408 |
mb | NS3_HCV1B | Genome polyprotein | -5.76 | -6.30 | -5.44 | 14.48% | CHEMBL1170408 |
ma | NS3_HCV3A | Genome polyprotein | -5.30 | -5.41 | -5.17 | N/A | N/A |
mb | NS3_HCV3A | Genome polyprotein | -5.63 | -5.79 | -5.96 | N/A | N/A |
ma | NS3_ZIKV | Genome polyprotein | -5.39 | N/A | N/A | N/A | N/A |
mb | NS3_ZIKV | Genome polyprotein | -5.66 | N/A | N/A | N/A | N/A |
ma | NS5B_HCV1A | Genome polyprotein | -6.21 | -5.75 | -5.91 | 33.66% | CHEMBL446360 |
mb | NS5B_HCV1A | Genome polyprotein | -6.38 | -6.36 | -6.50 | 33.02% | CHEMBL446360 |
ma | NS5B_HCV1B | Genome polyprotein | -5.56 | -6.12 | -5.71 | 17.51% | CHEMBL3645203 |
mb | NS5B_HCV1B | Genome polyprotein | -6.00 | -6.70 | -6.09 | 17.58% | CHEMBL3645203 |
ma | NS5B_HCV2A | Genome polyprotein | -5.85 | -6.01 | N/A | 16.91% | CHEMBL3127326 |
mb | NS5B_HCV2A | Genome polyprotein | -6.62 | -6.92 | N/A | 17.02% | CHEMBL3127326 |
ma | NS5_9FLAV | Core protein | -6.04 | N/A | N/A | N/A | N/A |
mb | NS5_9FLAV | Core protein | -6.19 | N/A | N/A | N/A | N/A |
ma | NS5_DEN3S | Genome polyprotein | -5.02 | -5.42 | N/A | N/A | N/A |
mb | NS5_DEN3S | Genome polyprotein | -5.86 | -5.79 | N/A | N/A | N/A |
ma | NS5_ZIKV | Genome polyprotein | -5.97 | -3.92 | N/A | N/A | N/A |
mb | NS5_ZIKV | Genome polyprotein | -6.78 | -4.17 | N/A | N/A | N/A |
ma | NS5_ZIKVF | Genome polyprotein | -5.76 | N/A | N/A | N/A | N/A |
mb | NS5_ZIKVF | Genome polyprotein | -6.16 | N/A | N/A | N/A | N/A |
ma | NS6_9CALI | NTPase | -3.61 | -5.92 | -4.74 | N/A | N/A |
mb | NS6_9CALI | NTPase | -4.08 | -6.14 | -5.31 | N/A | N/A |
ma | NSP15_SARS | Replicase polyprotein 1ab | -5.11 | N/A | N/A | 24.14% | CHEMBL471187 |
mb | NSP15_SARS | Replicase polyprotein 1ab | -5.13 | N/A | N/A | 21.88% | CHEMBL471187 |
ma | NSP15_SARS2 | Replicase polyprotein 1ab | -4.72 | N/A | N/A | N/A | N/A |
mb | NSP15_SARS2 | Replicase polyprotein 1ab | -5.22 | N/A | N/A | N/A | N/A |
ma | NSP1_INFB | Non-structural protein 1 | -4.20 | -4.33 | N/A | N/A | N/A |
mb | NSP1_INFB | Non-structural protein 1 | -4.27 | -4.42 | N/A | N/A | N/A |
ma | NSP1_SARS | Replicase polyprotein 1ab | -5.01 | N/A | N/A | 24.14% | CHEMBL471187 |
mb | NSP1_SARS | Replicase polyprotein 1ab | -5.26 | N/A | N/A | 21.88% | CHEMBL471187 |
ma | NSP3_HCoV-229E | Replicase polyprotein 1a | -6.17 | N/A | N/A | N/A | N/A |
mb | NSP3_HCoV-229E | Replicase polyprotein 1a | -6.83 | N/A | N/A | N/A | N/A |
ma | NSP3_IBV | Replicase polyprotein 1a | -6.25 | N/A | N/A | N/A | N/A |
mb | NSP3_IBV | Replicase polyprotein 1a | -7.02 | N/A | N/A | N/A | N/A |
ma | NSP3_MHV | Replicase polyprotein 1ab | -5.03 | N/A | N/A | N/A | N/A |
mb | NSP3_MHV | Replicase polyprotein 1ab | -5.49 | N/A | N/A | N/A | N/A |
ma | NSP3_SARS2 | Replicase polyprotein 1ab | -5.44 | N/A | N/A | N/A | N/A |
mb | NSP3_SARS2 | Replicase polyprotein 1ab | -5.73 | N/A | N/A | N/A | N/A |
ma | NSP9_HCoV-229E | Replicase polyprotein 1ab | -4.86 | -4.84 | N/A | N/A | N/A |
mb | NSP9_HCoV-229E | Replicase polyprotein 1ab | -5.30 | -5.01 | N/A | N/A | N/A |
ma | PA_A-H17N10 | Polymerase acidic protein | -5.59 | N/A | N/A | N/A | N/A |
mb | PA_A-H17N10 | Polymerase acidic protein | -5.83 | N/A | N/A | N/A | N/A |
ma | PA_A-H1N1 | Polymerase acidic protein | -5.63 | -5.33 | -5.24 | N/A | N/A |
mb | PA_A-H1N1 | Polymerase acidic protein | -5.53 | -6.02 | -5.84 | N/A | N/A |
ma | PA_A-H5N1 | Polymerase acidic protein | -5.75 | -5.81 | -5.77 | N/A | N/A |
mb | PA_A-H5N1 | Polymerase acidic protein | -6.01 | -5.75 | -6.29 | N/A | N/A |
ma | PA_INFA | Polymerase acidic protein | -5.83 | -4.94 | -5.52 | 50.00% | CHEMBL3600947 |
mb | PA_INFA | Polymerase acidic protein | -6.53 | -5.90 | -5.99 | 50.00% | CHEMBL3600947 |
ma | PA_INFB | Polymerase acidic protein | -5.30 | N/A | N/A | N/A | N/A |
mb | PA_INFB | Polymerase acidic protein | -5.70 | N/A | N/A | N/A | N/A |
ma | PB2_A-H3N2 | Polymerase basic protein 2 | -5.31 | -5.63 | N/A | N/A | N/A |
mb | PB2_A-H3N2 | Polymerase basic protein 2 | -5.57 | -5.96 | N/A | N/A | N/A |
ma | PB2_A-H5N1 | Polymerase basic protein 2 | -5.09 | -5.13 | -5.73 | N/A | N/A |
mb | PB2_A-H5N1 | Polymerase basic protein 2 | -5.98 | -5.73 | -6.33 | N/A | N/A |
ma | PB2_INFB | Polymerase basic protein 2 | -5.54 | N/A | N/A | N/A | N/A |
mb | PB2_INFB | Polymerase basic protein 2 | -6.35 | N/A | N/A | N/A | N/A |
ma | PB3_A-H3N2 | Polymerase basic protein 2 | -5.55 | N/A | N/A | N/A | N/A |
mb | PB3_A-H3N2 | Polymerase basic protein 2 | -6.01 | N/A | N/A | N/A | N/A |
ma | PB4_A-H3N2 | Polymerase basic protein 2 | -5.63 | N/A | N/A | N/A | N/A |
mb | PB4_A-H3N2 | Polymerase basic protein 2 | -6.58 | N/A | N/A | N/A | N/A |
ma | PLP_SARS | Replicase polyprotein 1a | -6.01 | -6.66 | -6.10 | 22.22% | CHEMBL222735 |
mb | PLP_SARS | Replicase polyprotein 1a | -6.49 | -6.60 | -6.10 | 24.59% | CHEMBL358279 |
ma | PLP_SARS2 | papain-like protease | -4.70 | N/A | N/A | N/A | N/A |
mb | PLP_SARS2 | papain-like protease | -5.17 | N/A | N/A | N/A | N/A |
ma | PM_9VIRU | RNA-directed RNA polymerase L | -5.59 | -5.57 | N/A | N/A | N/A |
mb | PM_9VIRU | RNA-directed RNA polymerase L | -5.73 | -5.76 | N/A | N/A | N/A |
ma | PR_FCoV | Replicase polyprotein 1ab | -4.91 | N/A | N/A | 15.17% | CHEMBL4214471 |
mb | PR_FCoV | Replicase polyprotein 1ab | -5.08 | N/A | N/A | 15.33% | CHEMBL4214471 |
ma | PR_HCoV-229E | Replicase polyprotein 1a | -4.93 | -5.01 | N/A | N/A | N/A |
mb | PR_HCoV-229E | Replicase polyprotein 1a | -5.65 | -5.42 | N/A | N/A | N/A |
ma | PR_HCoV-NL63 | Replicase polyprotein 1a | -3.97 | -5.07 | N/A | N/A | N/A |
mb | PR_HCoV-NL63 | Replicase polyprotein 1a | -4.70 | -5.42 | N/A | N/A | N/A |
ma | PR_HIV1 | Gag-Pol polyprotein | -4.38 | -5.11 | -5.09 | 17.11% | CHEMBL492666 |
mb | PR_HIV1 | Gag-Pol polyprotein | -5.10 | -5.51 | -5.58 | 17.20% | CHEMBL492666 |
ma | PR_HIV2 | Gag-Pol polyprotein | -5.35 | -4.69 | N/A | N/A | N/A |
mb | PR_HIV2 | Gag-Pol polyprotein | -5.89 | -4.98 | N/A | N/A | N/A |
ma | PR_HKU1 | Replicase polyprotein 1a | -4.91 | N/A | N/A | N/A | N/A |
mb | PR_HKU1 | Replicase polyprotein 1a | -5.49 | N/A | N/A | N/A | N/A |
ma | PR_HKU4 | Replicase polyprotein 1ab | -4.72 | -5.16 | -5.18 | N/A | N/A |
mb | PR_HKU4 | Replicase polyprotein 1ab | -5.18 | -5.58 | -5.62 | N/A | N/A |
ma | PR_IBV | Replicase polyprotein 1a | -5.23 | N/A | N/A | N/A | N/A |
mb | PR_IBV | Replicase polyprotein 1a | -6.20 | N/A | N/A | N/A | N/A |
ma | PR_MERs | 3C-like proteinase | -5.28 | -5.20 | N/A | N/A | N/A |
mb | PR_MERs | 3C-like proteinase | -5.61 | -5.77 | N/A | N/A | N/A |
ma | PR_PEDV | 3C-like proteinase | -4.93 | N/A | N/A | N/A | N/A |
mb | PR_PEDV | 3C-like proteinase | -5.50 | N/A | N/A | N/A | N/A |
ma | PR_SARS | Replicase polyprotein 1ab | -5.24 | -5.49 | -5.22 | 24.14% | CHEMBL471187 |
mb | PR_SARS | Replicase polyprotein 1ab | -5.88 | -5.98 | -5.59 | 21.88% | CHEMBL471187 |
ma | PR_SARS2 | 3C-like protease | -5.31 | N/A | N/A | N/A | N/A |
mb | PR_SARS2 | 3C-like protease | -5.89 | N/A | N/A | N/A | N/A |
ma | PR_TGEV | Replicase polyprotein 1a | -5.17 | N/A | N/A | N/A | N/A |
mb | PR_TGEV | Replicase polyprotein 1a | -5.85 | N/A | N/A | N/A | N/A |
ma | P_9CALI | Norovirus P domain protein | -6.10 | N/A | N/A | N/A | N/A |
mb | P_9CALI | Norovirus P domain protein | -6.45 | N/A | N/A | N/A | N/A |
ma | P_NVN68 | Capsid protein VP1 | -4.83 | N/A | N/A | N/A | N/A |
mb | P_NVN68 | Capsid protein VP1 | -4.49 | N/A | N/A | N/A | N/A |
ma | RDRP_SARS2 | RNA-dependent RNA polymerase | -5.29 | N/A | N/A | 10.07% | CHEMBL4065616 |
mb | RDRP_SARS2 | RNA-dependent RNA polymerase | -5.43 | N/A | N/A | 10.26% | CHEMBL4065616 |
ma | RT_HIV1 | Gag-Pol polyprotein | -6.37 | -6.32 | -6.57 | 26.09% | CHEMBL3775172 |
mb | RT_HIV1 | Gag-Pol polyprotein | -7.00 | -6.68 | -7.02 | 25.77% | CHEMBL3775172 |
ma | SPIKE_HCoV-229E | Spike glycoprotein | -3.85 | N/A | N/A | N/A | N/A |
mb | SPIKE_HCoV-229E | Spike glycoprotein | -3.89 | N/A | N/A | N/A | N/A |
ma | SPIKE_HCoV-NL63 | Spike glycoprotein | -4.06 | N/A | N/A | N/A | N/A |
mb | SPIKE_HCoV-NL63 | Spike glycoprotein | -4.52 | N/A | N/A | N/A | N/A |
ma | SPIKE_HCoV-OC43 | Spike glycoprotein | -5.09 | N/A | N/A | N/A | N/A |
mb | SPIKE_HCoV-OC43 | Spike glycoprotein | -5.63 | N/A | N/A | N/A | N/A |
ma | SPIKE_HKU4 | Spike glycoprotein | -5.20 | N/A | N/A | N/A | N/A |
mb | SPIKE_HKU4 | Spike glycoprotein | -5.27 | N/A | N/A | N/A | N/A |
ma | SPIKE_IBV | Spike glycoprotein | -4.35 | N/A | N/A | N/A | N/A |
mb | SPIKE_IBV | Spike glycoprotein | -4.84 | N/A | N/A | N/A | N/A |
ma | SPIKE_MERs | Spike glycoprotein | -5.21 | -5.24 | -4.17 | N/A | N/A |
mb | SPIKE_MERs | Spike glycoprotein | -5.30 | -5.48 | -5.01 | N/A | N/A |
ma | SPIKE_MHV | Spike glycoprotein | -4.90 | N/A | N/A | N/A | N/A |
mb | SPIKE_MHV | Spike glycoprotein | -5.52 | N/A | N/A | N/A | N/A |
ma | SPIKE_PDCoV | Spike protein | -4.51 | N/A | N/A | N/A | N/A |
mb | SPIKE_PDCoV | Spike protein | -4.79 | N/A | N/A | N/A | N/A |
ma | SPIKE_SARS | Spike glycoprotein | -4.63 | -5.16 | N/A | N/A | N/A |
mb | SPIKE_SARS | Spike glycoprotein | -5.02 | -5.57 | N/A | N/A | N/A |
ma | SPIKE_SARS2 | Spike glycoprotein | -4.88 | -4.10 | -4.93 | N/A | N/A |
mb | SPIKE_SARS2 | Spike glycoprotein | -5.21 | -4.87 | -5.21 | N/A | N/A |
ma | VP1_9CALI | Capsid protein | -5.93 | N/A | N/A | N/A | N/A |
mb | VP1_9CALI | Capsid protein | -6.71 | N/A | N/A | N/A | N/A |
ma | VP1_NVN68 | Capsid protein VP1 | -4.46 | N/A | N/A | N/A | N/A |
mb | VP1_NVN68 | Capsid protein VP1 | -4.83 | N/A | N/A | N/A | N/A |
ma | VP24_EBORE | Membrane-associated protein VP24 | -4.47 | N/A | N/A | N/A | N/A |
mb | VP24_EBORE | Membrane-associated protein VP24 | -4.29 | N/A | N/A | N/A | N/A |
ma | VP24_EBOSU | Membrane-associated protein VP24 | -3.64 | N/A | N/A | N/A | N/A |
mb | VP24_EBOSU | Membrane-associated protein VP24 | -3.79 | N/A | N/A | N/A | N/A |
ma | VP24_EBOZM | Membrane-associated protein VP24 | -4.22 | N/A | N/A | N/A | N/A |
mb | VP24_EBOZM | Membrane-associated protein VP24 | -4.40 | N/A | N/A | N/A | N/A |
ma | VP30_9MONO | Minor nucleoprotein VP30 | -4.37 | N/A | N/A | N/A | N/A |
mb | VP30_9MONO | Minor nucleoprotein VP30 | -5.01 | N/A | N/A | N/A | N/A |
ma | VP30_EBOZ5 | Transcriptional activator VP30 | -5.26 | N/A | N/A | N/A | N/A |
mb | VP30_EBOZ5 | Transcriptional activator VP30 | -5.78 | N/A | N/A | N/A | N/A |
ma | VP30_EBOZM | Transcriptional activator VP30 | -5.35 | N/A | N/A | N/A | N/A |
mb | VP30_EBOZM | Transcriptional activator VP30 | -6.20 | N/A | N/A | N/A | N/A |
ma | VP35_EBORR | Polymerase cofactor VP35 | -4.38 | N/A | N/A | N/A | N/A |
mb | VP35_EBORR | Polymerase cofactor VP35 | -4.68 | N/A | N/A | N/A | N/A |
ma | VP35_EBOZM | Polymerase cofactor VP35 | -4.47 | -4.64 | -4.97 | N/A | N/A |
mb | VP35_EBOZM | Polymerase cofactor VP35 | -4.77 | -5.07 | -5.47 | N/A | N/A |
ma | VP40_EBOZM | Matrix protein VP40 | -4.49 | -4.13 | N/A | N/A | N/A |
mb | VP40_EBOZM | Matrix protein VP40 | -4.68 | -4.67 | N/A | N/A | N/A |