Protein Symbol | Approved Name | Docking Scores |
Similarity Score |
Best Match | ||
---|---|---|---|---|---|---|
Model 1 | Model 2 | Model 3 | ||||
2A_HE71 | Genome polyprotein | -5.68 | N/A | N/A | N/A | N/A |
2A_HE71M | Genome polyprotein | -5.68 | N/A | N/A | N/A | N/A |
2C_HE71 | Genome polyprotein | -4.36 | -4.54 | N/A | N/A | N/A |
3A_9ENTO | Genome polyprotein | -4.76 | N/A | N/A | N/A | N/A |
3A_HE71M | Genome polyprotein | -4.83 | N/A | N/A | N/A | N/A |
3A_HED68 | Genome polyprotein | -4.52 | N/A | N/A | N/A | N/A |
3C_HE71 | Genome polyprotein | -5.23 | -4.91 | N/A | N/A | N/A |
3C_HED68 | Genome polyprotein | -4.09 | N/A | N/A | N/A | N/A |
3D_HE71 | Genome polyprotein | -6.81 | N/A | N/A | N/A | N/A |
3D_HED68 | Genome polyprotein | -5.65 | N/A | N/A | N/A | N/A |
ACE2_HUMAN | angiotensin converting enzyme 2 | -6.53 | N/A | N/A | 25.88% | CHEMBL400526 |
CAPSD_9CALI | Capsid protein | -5.57 | -5.54 | -5.97 | N/A | N/A |
CAPSD_9ENTO | Genome polyprotein | -7.59 | N/A | N/A | N/A | N/A |
CAPSD_DEN2P | Genome polyprotein | -6.56 | N/A | N/A | N/A | N/A |
CAPSD_HCV77 | Genome polyprotein | -3.40 | N/A | N/A | 28.38% | CHEMBL4110799 |
CAPSD_HED68 | Capsid protein VP0 | -7.69 | -7.33 | N/A | N/A | N/A |
CAPSD_ZIKV | Core protein | -6.11 | -5.63 | N/A | N/A | N/A |
DPM_HHV1K | DNA polymerase catalytic subunit | -6.92 | N/A | N/A | 15.79% | CHEMBL29711 |
E1_9HEPC | Envelope glycoprotein E1 | -4.32 | N/A | N/A | N/A | N/A |
E1_HCV77 | Genome polyprotein | -3.93 | N/A | N/A | 28.38% | CHEMBL4110799 |
E1_HCVJ1 | Genome polyprotein | -3.85 | N/A | N/A | N/A | N/A |
E2_9HEPC | Core protein precursor | -6.64 | N/A | N/A | N/A | N/A |
E2_HCV77 | Genome polyprotein | -4.57 | N/A | N/A | 28.38% | CHEMBL4110799 |
ENV_9FLAV | Envelope protein E | -3.72 | N/A | N/A | N/A | N/A |
ENV_DEN1B | Genome polyprotein | -3.93 | N/A | N/A | N/A | N/A |
ENV_DEN2P | Genome polyprotein | -5.04 | N/A | N/A | N/A | N/A |
ENV_DEN3P | Genome polyprotein | -5.40 | N/A | N/A | N/A | N/A |
ENV_HHV2H | Envelope glycoprotein H | -5.71 | N/A | N/A | N/A | N/A |
ENV_ZIKV | Core protein | -3.85 | N/A | N/A | N/A | N/A |
ENV_ZIKVK | Genome polyprotein | -4.13 | N/A | N/A | N/A | N/A |
G1_ADNV | Envelope polyprotein | -3.49 | -5.44 | -5.39 | N/A | N/A |
G2_ADNV | Envelope polyprotein | -5.94 | -5.96 | -4.52 | N/A | N/A |
GB_HHV11 | Envelope glycoprotein B | -5.95 | N/A | N/A | N/A | N/A |
GB_HHV1K | Envelope glycoprotein B | -6.62 | -6.36 | N/A | N/A | N/A |
GD_9ALPH | Glycoprotein D | -5.23 | -5.00 | N/A | N/A | N/A |
GD_HHV1 | Glycoprotein D | -4.70 | N/A | N/A | N/A | N/A |
GP160_HIV1 | Envelope glycoprotein gp160 | -6.34 | -5.95 | -4.13 | N/A | N/A |
GP160_HIV2 | Envelope glycoprotein gp160 | -5.31 | N/A | N/A | N/A | N/A |
GP_EBOV | Envelope glycoprotein | -6.19 | -6.20 | -6.33 | 24.71% | CHEMBL1655 |
GP_LASSJ | Pre-glycoprotein polyprotein GP complex | -4.41 | -4.90 | N/A | N/A | N/A |
HA_A-H10N7 | Hemagglutinin | -5.71 | N/A | N/A | N/A | N/A |
HA_A-H10N8 | Hemagglutinin | -5.40 | N/A | N/A | N/A | N/A |
HA_A-H13N6 | Hemagglutinin | -5.23 | N/A | N/A | N/A | N/A |
HA_A-H14N6 | Hemagglutinin | -5.46 | N/A | N/A | N/A | N/A |
HA_A-H15N9 | Hemagglutinin | -5.21 | N/A | N/A | N/A | N/A |
HA_A-H17N10 | Hemagglutinin | -4.05 | N/A | N/A | N/A | N/A |
HA_A-H18N11 | Hemagglutinin | -3.91 | N/A | N/A | N/A | N/A |
HA_A-H1N1 | Hemagglutinin | -5.21 | -4.86 | N/A | N/A | N/A |
HA_A-H2N2 | Hemagglutinin | -4.34 | -4.67 | N/A | N/A | N/A |
HA_A-H3N2 | Hemagglutinin | -4.91 | -4.80 | -4.89 | N/A | N/A |
HA_A-H3N8 | Hemagglutinin | -5.07 | -5.06 | -5.01 | N/A | N/A |
HA_A-H5N1 | Hemagglutinin | -4.89 | -5.35 | -5.13 | N/A | N/A |
HA_A-H5N3 | Hemagglutinin | -5.73 | -5.19 | N/A | N/A | N/A |
HA_A-H6N1 | Hemagglutinin | -5.40 | N/A | N/A | N/A | N/A |
HA_A-H6N6 | Hemagglutinin | -5.17 | N/A | N/A | N/A | N/A |
HA_A-H7N2 | Hemagglutinin | -5.46 | -4.68 | -5.28 | N/A | N/A |
HA_A-H7N7 | Hemagglutinin | -5.18 | -5.17 | N/A | N/A | N/A |
HA_A-H7N9 | Hemagglutinin | -5.18 | N/A | N/A | N/A | N/A |
HA_INFB | Hemagglutinin | -5.06 | -5.15 | N/A | N/A | N/A |
HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -4.98 | N/A | N/A | N/A | N/A |
HE_BCV | Hemagglutinin-esterase | -5.94 | -5.23 | N/A | N/A | N/A |
HE_HCoV-OC43 | Hemagglutinin-esterase | -5.05 | N/A | N/A | N/A | N/A |
HE_MHV | Hemagglutinin-esterase | -4.87 | N/A | N/A | N/A | N/A |
IN_HIV1 | Gag-Pol polyprotein | -4.61 | -4.52 | N/A | N/A | N/A |
MD_HKU4 | Replicase polyprotein 1ab | -6.90 | -6.96 | -7.03 | N/A | N/A |
MD_MERs | Replicase polyprotein 1a | -6.92 | -6.54 | N/A | N/A | N/A |
MEM_9FLAV | Core protein | -4.73 | N/A | N/A | N/A | N/A |
MTASE_SARS2 | Methyltransferase | -4.53 | N/A | N/A | N/A | N/A |
MTASE_SARS2 | Methyltransferase | -5.31 | N/A | N/A | N/A | N/A |
MX2_A-H5N1 | Matrix protein 2 | -6.32 | N/A | N/A | N/A | N/A |
MX_9MONO | Matrix protein VP40 | -6.19 | N/A | N/A | N/A | N/A |
MX_LASSJ | RING finger protein Z | -4.35 | N/A | N/A | N/A | N/A |
NA_A-H11N6 | Neuraminidase | -5.46 | -5.44 | -5.34 | N/A | N/A |
NA_A-H11N9 | Neuraminidase | -6.53 | -5.55 | -5.81 | N/A | N/A |
NA_A-H12N5 | Neuraminidase | -5.80 | -5.57 | -5.52 | N/A | N/A |
NA_A-H13N9 | Neuraminidase | -4.59 | N/A | N/A | N/A | N/A |
NA_A-H17N10 | Neuraminidase | -5.10 | N/A | N/A | N/A | N/A |
NA_A-H18N11 | Neuraminidase | -5.12 | N/A | N/A | N/A | N/A |
NA_A-H1N1 | Neuraminidase | -6.35 | N/A | N/A | N/A | N/A |
NA_A-H2N2 | Neuraminidase | -5.61 | -5.35 | -5.55 | N/A | N/A |
NA_A-H3N2 | Ig heavy chain Mem5 | -4.66 | -4.93 | N/A | N/A | N/A |
NA_A-H3N8 | Neuraminidase | -5.43 | -6.30 | -5.54 | 13.70% | CHEMBL4285767 |
NA_A-H5N1 | Neuraminidase | -6.07 | N/A | N/A | N/A | N/A |
NA_A-H7N9 | Neuraminidase | -5.71 | -5.68 | -5.72 | N/A | N/A |
NA_INFB | Neuraminidase | -5.35 | -5.60 | N/A | 20.16% | CHEMBL81286 |
NP_9ADNV | Nucleoprotein | -4.07 | -6.49 | N/A | N/A | N/A |
NP_A-H1N1 | Nucleoprotein | -5.62 | -7.30 | -5.65 | N/A | N/A |
NP_A-H5N1 | Nucleoprotein | -5.76 | N/A | N/A | N/A | N/A |
NP_EBOZM | Nucleoprotein | -6.10 | -4.37 | -5.28 | N/A | N/A |
NP_HCoV-NL63 | Nucleoprotein | -4.32 | N/A | N/A | N/A | N/A |
NP_HCoV-OC43 | Nucleoprotein | -7.35 | -6.27 | -5.69 | 9.64% | CHEMBL3233481 |
NP_INFB | Nucleoprotein | -4.04 | N/A | N/A | N/A | N/A |
NP_INFD | NP | -4.63 | N/A | N/A | N/A | N/A |
NP_LASSJ | Nucleoprotein | -7.36 | -7.71 | -3.68 | N/A | N/A |
NP_SARS | Nucleoprotein | -5.28 | N/A | N/A | N/A | N/A |
NS1_9CALI | NTPase | -5.01 | -4.52 | -4.73 | N/A | N/A |
NS1_9FLAV | Non-structural protein 1 | -5.96 | N/A | N/A | N/A | N/A |
NS1_DEN1W | Genome polyprotein | -4.35 | N/A | N/A | N/A | N/A |
NS1_ZIKV | Core protein | -6.41 | -5.55 | -4.94 | N/A | N/A |
NS2A_9FLAV | Core protein | -4.50 | N/A | N/A | N/A | N/A |
NS2B_DEN1W | Genome polyprotein | -5.18 | N/A | N/A | N/A | N/A |
NS2B_DEN2P | Genome polyprotein | -6.26 | -5.34 | N/A | N/A | N/A |
NS2B_ZIKV | Genome polyprotein | -5.67 | -5.39 | N/A | N/A | N/A |
NS2B_ZIKVF | Genome polyprotein | -5.87 | N/A | N/A | N/A | N/A |
NS3_9FLAV | Core protein | -5.55 | N/A | N/A | N/A | N/A |
NS3_DEN4T | Genome polyprotein | -6.18 | -5.46 | N/A | N/A | N/A |
NS3_HCV1A | Genome polyprotein | -6.25 | -4.86 | -5.96 | 28.38% | CHEMBL4110799 |
NS3_HCV1B | Genome polyprotein | -6.16 | -5.78 | -4.95 | 9.52% | CHEMBL3954962 |
NS3_HCV3A | Genome polyprotein | -5.28 | -5.23 | -4.96 | N/A | N/A |
NS3_ZIKV | Genome polyprotein | -6.01 | N/A | N/A | N/A | N/A |
NS5B_HCV1A | Genome polyprotein | -5.60 | -6.77 | -6.57 | 29.07% | CHEMBL175894 |
NS5B_HCV1B | Genome polyprotein | -6.58 | -6.63 | -6.47 | 12.77% | CHEMBL99408 |
NS5B_HCV2A | Genome polyprotein | -7.29 | -6.91 | N/A | 21.14% | CHEMBL3127326 |
NS5_9FLAV | Core protein | -5.68 | N/A | N/A | N/A | N/A |
NS5_DEN3S | Genome polyprotein | -4.81 | -5.89 | N/A | N/A | N/A |
NS5_ZIKV | Genome polyprotein | -5.70 | -4.65 | N/A | N/A | N/A |
NS5_ZIKVF | Genome polyprotein | -5.69 | N/A | N/A | N/A | N/A |
NS6_9CALI | NTPase | -4.04 | -4.69 | -4.65 | N/A | N/A |
NSP15_SARS | Replicase polyprotein 1ab | -4.99 | N/A | N/A | 19.66% | CHEMBL2441741 |
NSP15_SARS2 | Replicase polyprotein 1ab | -5.31 | N/A | N/A | N/A | N/A |
NSP1_INFB | Non-structural protein 1 | -5.29 | -5.16 | N/A | N/A | N/A |
NSP1_SARS | Replicase polyprotein 1ab | -4.52 | N/A | N/A | 19.66% | CHEMBL2441741 |
NSP3_HCoV-229E | Replicase polyprotein 1a | -7.14 | N/A | N/A | N/A | N/A |
NSP3_IBV | Replicase polyprotein 1a | -6.57 | N/A | N/A | N/A | N/A |
NSP3_MHV | Replicase polyprotein 1ab | -5.63 | N/A | N/A | N/A | N/A |
NSP3_SARS2 | Replicase polyprotein 1ab | -5.94 | N/A | N/A | N/A | N/A |
NSP9_HCoV-229E | Replicase polyprotein 1ab | -6.74 | -5.26 | N/A | N/A | N/A |
PA_A-H17N10 | Polymerase acidic protein | -5.01 | N/A | N/A | N/A | N/A |
PA_A-H1N1 | Polymerase acidic protein | -6.39 | -5.74 | -5.44 | N/A | N/A |
PA_A-H5N1 | Polymerase acidic protein | -5.40 | -5.28 | -5.44 | N/A | N/A |
PA_INFA | Polymerase acidic protein | -7.12 | -5.01 | -5.03 | 27.78% | CHEMBL2040554 |
PA_INFB | Polymerase acidic protein | -5.24 | N/A | N/A | N/A | N/A |
PB2_A-H3N2 | Polymerase basic protein 2 | -6.22 | -6.71 | N/A | N/A | N/A |
PB2_A-H5N1 | Polymerase basic protein 2 | -6.05 | -6.17 | -6.47 | N/A | N/A |
PB2_INFB | Polymerase basic protein 2 | -6.62 | N/A | N/A | N/A | N/A |
PB3_A-H3N2 | Polymerase basic protein 2 | -6.69 | N/A | N/A | N/A | N/A |
PB4_A-H3N2 | Polymerase basic protein 2 | -6.10 | N/A | N/A | N/A | N/A |
PLP_SARS | Replicase polyprotein 1a | -7.08 | -7.14 | -7.07 | 14.29% | CHEMBL358279 |
PLP_SARS2 | papain-like protease | -4.69 | N/A | N/A | N/A | N/A |
PM_9VIRU | RNA-directed RNA polymerase L | -6.84 | -5.66 | N/A | N/A | N/A |
PR_FCoV | Replicase polyprotein 1ab | -5.02 | N/A | N/A | 18.94% | CHEMBL4214471 |
PR_HCoV-229E | Replicase polyprotein 1a | -5.10 | -4.74 | N/A | N/A | N/A |
PR_HCoV-NL63 | Replicase polyprotein 1a | -5.06 | -5.17 | N/A | N/A | N/A |
PR_HIV1 | Gag-Pol polyprotein | -5.33 | -5.32 | -5.61 | 17.48% | CHEMBL492666 |
PR_HIV2 | Gag-Pol polyprotein | -5.87 | -4.78 | N/A | N/A | N/A |
PR_HKU1 | Replicase polyprotein 1a | -5.07 | N/A | N/A | N/A | N/A |
PR_HKU4 | Replicase polyprotein 1ab | -4.77 | -5.40 | -5.39 | N/A | N/A |
PR_IBV | Replicase polyprotein 1a | -5.30 | N/A | N/A | N/A | N/A |
PR_MERs | 3C-like proteinase | -5.15 | -5.17 | N/A | N/A | N/A |
PR_PEDV | 3C-like proteinase | -5.05 | N/A | N/A | N/A | N/A |
PR_SARS | Replicase polyprotein 1ab | -4.85 | -4.61 | -5.00 | 19.66% | CHEMBL2441741 |
PR_SARS2 | 3C-like protease | -4.77 | N/A | N/A | N/A | N/A |
PR_TGEV | Replicase polyprotein 1a | -5.12 | N/A | N/A | N/A | N/A |
P_9CALI | Norovirus P domain protein | -6.45 | N/A | N/A | N/A | N/A |
P_NVN68 | Capsid protein VP1 | -4.43 | N/A | N/A | N/A | N/A |
RDRP_SARS2 | RNA-dependent RNA polymerase | -4.84 | N/A | N/A | 10.04% | CHEMBL4065616 |
RT_HIV1 | Gag-Pol polyprotein | -7.82 | -8.05 | -8.20 | 34.18% | CHEMBL3775172 |
SPIKE_HCoV-229E | Spike glycoprotein | -4.25 | N/A | N/A | N/A | N/A |
SPIKE_HCoV-NL63 | Spike glycoprotein | -4.52 | N/A | N/A | N/A | N/A |
SPIKE_HCoV-OC43 | Spike glycoprotein | -4.62 | N/A | N/A | N/A | N/A |
SPIKE_HKU4 | Spike glycoprotein | -4.96 | N/A | N/A | N/A | N/A |
SPIKE_IBV | Spike glycoprotein | -5.14 | N/A | N/A | N/A | N/A |
SPIKE_MERs | Spike glycoprotein | -5.18 | -4.68 | -4.37 | N/A | N/A |
SPIKE_MHV | Spike glycoprotein | -5.32 | N/A | N/A | N/A | N/A |
SPIKE_PDCoV | Spike protein | -4.80 | N/A | N/A | N/A | N/A |
SPIKE_SARS | Spike glycoprotein | -4.54 | -5.19 | N/A | N/A | N/A |
SPIKE_SARS2 | Spike glycoprotein | -4.63 | -4.57 | -5.10 | N/A | N/A |
VP1_9CALI | Capsid protein | -5.18 | N/A | N/A | N/A | N/A |
VP1_NVN68 | Capsid protein VP1 | -4.58 | N/A | N/A | N/A | N/A |
VP24_EBORE | Membrane-associated protein VP24 | -4.73 | N/A | N/A | N/A | N/A |
VP24_EBOSU | Membrane-associated protein VP24 | -3.50 | N/A | N/A | N/A | N/A |
VP24_EBOZM | Membrane-associated protein VP24 | -4.85 | N/A | N/A | N/A | N/A |
VP30_9MONO | Minor nucleoprotein VP30 | -4.85 | N/A | N/A | N/A | N/A |
VP30_EBOZ5 | Transcriptional activator VP30 | -5.87 | N/A | N/A | N/A | N/A |
VP30_EBOZM | Transcriptional activator VP30 | -6.05 | N/A | N/A | N/A | N/A |
VP35_EBORR | Polymerase cofactor VP35 | -5.01 | N/A | N/A | N/A | N/A |
VP35_EBOZM | Polymerase cofactor VP35 | -5.48 | -5.18 | -5.36 | N/A | N/A |
VP40_EBOZM | Matrix protein VP40 | -4.78 | -4.83 | N/A | N/A | N/A |