Protein Symbol | Approved Name | Docking Scores |
Similarity Score |
Best Match | ||
---|---|---|---|---|---|---|
Model 1 | Model 2 | Model 3 | ||||
2A_HE71 | Genome polyprotein | -6.70 | N/A | N/A | N/A | N/A |
2A_HE71M | Genome polyprotein | -7.20 | N/A | N/A | N/A | N/A |
2C_HE71 | Genome polyprotein | -4.57 | -5.16 | N/A | N/A | N/A |
3A_9ENTO | Genome polyprotein | -5.04 | N/A | N/A | N/A | N/A |
3A_HE71M | Genome polyprotein | -5.08 | N/A | N/A | N/A | N/A |
3A_HED68 | Genome polyprotein | -4.76 | N/A | N/A | N/A | N/A |
3C_HE71 | Genome polyprotein | -6.95 | -6.48 | N/A | N/A | N/A |
3C_HED68 | Genome polyprotein | -4.89 | N/A | N/A | N/A | N/A |
3D_HE71 | Genome polyprotein | -8.02 | N/A | N/A | N/A | N/A |
3D_HED68 | Genome polyprotein | -7.53 | N/A | N/A | N/A | N/A |
ACE2_HUMAN | angiotensin converting enzyme 2 | -8.18 | N/A | N/A | 33.64% | CHEMBL254703 |
CAPSD_9CALI | Capsid protein | -7.01 | -6.62 | -6.91 | N/A | N/A |
CAPSD_9ENTO | Genome polyprotein | -9.67 | N/A | N/A | N/A | N/A |
CAPSD_DEN2P | Genome polyprotein | -8.09 | N/A | N/A | N/A | N/A |
CAPSD_HCV77 | Genome polyprotein | -3.78 | N/A | N/A | 23.30% | CHEMBL4107993 |
CAPSD_HED68 | Capsid protein VP0 | -8.45 | -9.03 | N/A | N/A | N/A |
CAPSD_ZIKV | Core protein | -6.94 | -5.96 | N/A | N/A | N/A |
DPM_HHV1K | DNA polymerase catalytic subunit | -8.49 | N/A | N/A | 10.65% | CHEMBL479371 |
E1_9HEPC | Envelope glycoprotein E1 | -4.61 | N/A | N/A | N/A | N/A |
E1_HCV77 | Genome polyprotein | -3.74 | N/A | N/A | 23.30% | CHEMBL4107993 |
E1_HCVJ1 | Genome polyprotein | -4.98 | N/A | N/A | N/A | N/A |
E2_9HEPC | Core protein precursor | -8.12 | N/A | N/A | N/A | N/A |
E2_HCV77 | Genome polyprotein | -5.33 | N/A | N/A | 23.30% | CHEMBL4107993 |
ENV_9FLAV | Envelope protein E | -4.59 | N/A | N/A | N/A | N/A |
ENV_DEN1B | Genome polyprotein | -4.34 | N/A | N/A | N/A | N/A |
ENV_DEN2P | Genome polyprotein | -5.24 | N/A | N/A | N/A | N/A |
ENV_DEN3P | Genome polyprotein | -5.11 | N/A | N/A | N/A | N/A |
ENV_HHV2H | Envelope glycoprotein H | -7.14 | N/A | N/A | N/A | N/A |
ENV_ZIKV | Core protein | -4.73 | N/A | N/A | N/A | N/A |
ENV_ZIKVK | Genome polyprotein | -6.06 | N/A | N/A | N/A | N/A |
G1_ADNV | Envelope polyprotein | -3.76 | -6.50 | -6.45 | N/A | N/A |
G2_ADNV | Envelope polyprotein | -7.18 | -6.73 | -5.09 | N/A | N/A |
GB_HHV11 | Envelope glycoprotein B | -7.07 | N/A | N/A | N/A | N/A |
GB_HHV1K | Envelope glycoprotein B | -7.73 | -5.95 | N/A | N/A | N/A |
GD_9ALPH | Glycoprotein D | -6.49 | -5.76 | N/A | N/A | N/A |
GD_HHV1 | Glycoprotein D | -5.84 | N/A | N/A | N/A | N/A |
GP160_HIV1 | Envelope glycoprotein gp160 | -7.30 | -7.41 | -7.51 | N/A | N/A |
GP160_HIV2 | Envelope glycoprotein gp160 | -5.09 | N/A | N/A | N/A | N/A |
GP_EBOV | Envelope glycoprotein | -6.61 | -8.06 | -7.98 | 27.96% | CHEMBL1655 |
GP_LASSJ | Pre-glycoprotein polyprotein GP complex | -5.68 | -5.63 | N/A | N/A | N/A |
HA_A-H10N7 | Hemagglutinin | -6.65 | N/A | N/A | N/A | N/A |
HA_A-H10N8 | Hemagglutinin | -6.06 | N/A | N/A | N/A | N/A |
HA_A-H13N6 | Hemagglutinin | -5.29 | N/A | N/A | N/A | N/A |
HA_A-H14N6 | Hemagglutinin | -5.39 | N/A | N/A | N/A | N/A |
HA_A-H15N9 | Hemagglutinin | -5.54 | N/A | N/A | N/A | N/A |
HA_A-H17N10 | Hemagglutinin | -6.36 | N/A | N/A | N/A | N/A |
HA_A-H18N11 | Hemagglutinin | -5.69 | N/A | N/A | N/A | N/A |
HA_A-H1N1 | Hemagglutinin | -5.24 | -5.21 | N/A | N/A | N/A |
HA_A-H2N2 | Hemagglutinin | -5.39 | -6.15 | N/A | N/A | N/A |
HA_A-H3N2 | Hemagglutinin | -5.34 | -5.44 | -5.38 | N/A | N/A |
HA_A-H3N8 | Hemagglutinin | -6.06 | -4.94 | -4.78 | N/A | N/A |
HA_A-H5N1 | Hemagglutinin | -6.21 | -5.27 | -5.04 | N/A | N/A |
HA_A-H5N3 | Hemagglutinin | -6.16 | -4.94 | N/A | N/A | N/A |
HA_A-H6N1 | Hemagglutinin | -6.06 | N/A | N/A | N/A | N/A |
HA_A-H6N6 | Hemagglutinin | -5.20 | N/A | N/A | N/A | N/A |
HA_A-H7N2 | Hemagglutinin | -5.03 | -4.89 | -5.13 | N/A | N/A |
HA_A-H7N7 | Hemagglutinin | -5.37 | -5.48 | N/A | N/A | N/A |
HA_A-H7N9 | Hemagglutinin | -5.84 | N/A | N/A | N/A | N/A |
HA_INFB | Hemagglutinin | -6.01 | -5.56 | N/A | N/A | N/A |
HA_INFD | Hemagglutinin-esterase-fusion glycoprotein | -5.13 | N/A | N/A | N/A | N/A |
HE_BCV | Hemagglutinin-esterase | -6.23 | -5.40 | N/A | N/A | N/A |
HE_HCoV-OC43 | Hemagglutinin-esterase | -5.23 | N/A | N/A | N/A | N/A |
HE_MHV | Hemagglutinin-esterase | -6.37 | N/A | N/A | N/A | N/A |
IN_HIV1 | Gag-Pol polyprotein | -5.11 | -5.09 | N/A | N/A | N/A |
MD_HKU4 | Replicase polyprotein 1ab | -8.34 | -8.03 | -7.15 | N/A | N/A |
MD_MERs | Replicase polyprotein 1a | -8.27 | -7.43 | N/A | N/A | N/A |
MEM_9FLAV | Core protein | -5.15 | N/A | N/A | N/A | N/A |
MTASE_SARS2 | Methyltransferase | -5.12 | N/A | N/A | N/A | N/A |
MTASE_SARS2 | Methyltransferase | -6.44 | N/A | N/A | N/A | N/A |
MX2_A-H5N1 | Matrix protein 2 | -8.02 | N/A | N/A | N/A | N/A |
MX_9MONO | Matrix protein VP40 | -6.82 | N/A | N/A | N/A | N/A |
MX_LASSJ | RING finger protein Z | -4.53 | N/A | N/A | N/A | N/A |
NA_A-H11N6 | Neuraminidase | -6.44 | -6.79 | -6.66 | N/A | N/A |
NA_A-H11N9 | Neuraminidase | -7.87 | -6.75 | -6.70 | N/A | N/A |
NA_A-H12N5 | Neuraminidase | -6.41 | -6.64 | -6.39 | N/A | N/A |
NA_A-H13N9 | Neuraminidase | -6.94 | N/A | N/A | N/A | N/A |
NA_A-H17N10 | Neuraminidase | -5.86 | N/A | N/A | N/A | N/A |
NA_A-H18N11 | Neuraminidase | -5.86 | N/A | N/A | N/A | N/A |
NA_A-H1N1 | Neuraminidase | -6.60 | N/A | N/A | N/A | N/A |
NA_A-H2N2 | Neuraminidase | -6.37 | -6.28 | -5.93 | N/A | N/A |
NA_A-H3N2 | Ig heavy chain Mem5 | -6.37 | -6.48 | N/A | N/A | N/A |
NA_A-H3N8 | Neuraminidase | -6.49 | -6.24 | -6.79 | 15.92% | CHEMBL4292576 |
NA_A-H5N1 | Neuraminidase | -6.63 | N/A | N/A | N/A | N/A |
NA_A-H7N9 | Neuraminidase | -6.31 | -6.48 | -6.25 | N/A | N/A |
NA_INFB | Neuraminidase | -6.61 | -5.68 | N/A | 12.75% | CHEMBL81286 |
NP_9ADNV | Nucleoprotein | -5.43 | -7.30 | N/A | N/A | N/A |
NP_A-H1N1 | Nucleoprotein | -5.78 | -7.64 | -6.10 | N/A | N/A |
NP_A-H5N1 | Nucleoprotein | -6.31 | N/A | N/A | N/A | N/A |
NP_EBOZM | Nucleoprotein | -6.75 | -5.13 | -6.73 | N/A | N/A |
NP_HCoV-NL63 | Nucleoprotein | -5.48 | N/A | N/A | N/A | N/A |
NP_HCoV-OC43 | Nucleoprotein | -8.48 | -7.10 | -6.48 | 7.22% | CHEMBL3233481 |
NP_INFB | Nucleoprotein | -4.60 | N/A | N/A | N/A | N/A |
NP_INFD | NP | -5.23 | N/A | N/A | N/A | N/A |
NP_LASSJ | Nucleoprotein | -8.92 | -8.80 | -3.97 | N/A | N/A |
NP_SARS | Nucleoprotein | -8.01 | N/A | N/A | N/A | N/A |
NS1_9CALI | NTPase | -5.52 | -5.03 | -5.04 | N/A | N/A |
NS1_9FLAV | Non-structural protein 1 | -5.51 | N/A | N/A | N/A | N/A |
NS1_DEN1W | Genome polyprotein | -4.72 | N/A | N/A | N/A | N/A |
NS1_ZIKV | Core protein | -6.46 | -6.42 | -5.88 | N/A | N/A |
NS2A_9FLAV | Core protein | -3.92 | N/A | N/A | N/A | N/A |
NS2B_DEN1W | Genome polyprotein | -6.56 | N/A | N/A | N/A | N/A |
NS2B_DEN2P | Genome polyprotein | -7.34 | -6.54 | N/A | N/A | N/A |
NS2B_ZIKV | Genome polyprotein | -6.49 | -6.85 | N/A | N/A | N/A |
NS2B_ZIKVF | Genome polyprotein | -7.46 | N/A | N/A | N/A | N/A |
NS3_9FLAV | Core protein | -6.60 | N/A | N/A | N/A | N/A |
NS3_DEN4T | Genome polyprotein | -8.14 | -6.98 | N/A | N/A | N/A |
NS3_HCV1A | Genome polyprotein | -6.60 | -6.10 | -8.64 | 23.30% | CHEMBL4107993 |
NS3_HCV1B | Genome polyprotein | -8.85 | -8.33 | -5.63 | 12.61% | CHEMBL1170408 |
NS3_HCV3A | Genome polyprotein | -6.46 | -6.43 | -6.76 | N/A | N/A |
NS3_ZIKV | Genome polyprotein | -7.21 | N/A | N/A | N/A | N/A |
NS5B_HCV1A | Genome polyprotein | -6.65 | -8.55 | -8.54 | 23.21% | CHEMBL446360 |
NS5B_HCV1B | Genome polyprotein | -7.19 | -8.34 | -8.24 | 15.58% | CHEMBL3645180 |
NS5B_HCV2A | Genome polyprotein | -9.07 | -8.66 | N/A | 10.96% | CHEMBL3127326 |
NS5_9FLAV | Core protein | -7.06 | N/A | N/A | N/A | N/A |
NS5_DEN3S | Genome polyprotein | -7.03 | -7.84 | N/A | N/A | N/A |
NS5_ZIKV | Genome polyprotein | -6.53 | -5.02 | N/A | N/A | N/A |
NS5_ZIKVF | Genome polyprotein | -6.97 | N/A | N/A | N/A | N/A |
NS6_9CALI | NTPase | -4.08 | -5.63 | -6.28 | N/A | N/A |
NSP15_SARS | Replicase polyprotein 1ab | -6.25 | N/A | N/A | 36.36% | CHEMBL471187 |
NSP15_SARS2 | Replicase polyprotein 1ab | -5.96 | N/A | N/A | N/A | N/A |
NSP1_INFB | Non-structural protein 1 | -6.03 | -5.89 | N/A | N/A | N/A |
NSP1_SARS | Replicase polyprotein 1ab | -5.98 | N/A | N/A | 36.36% | CHEMBL471187 |
NSP3_HCoV-229E | Replicase polyprotein 1a | -9.43 | N/A | N/A | N/A | N/A |
NSP3_IBV | Replicase polyprotein 1a | -8.56 | N/A | N/A | N/A | N/A |
NSP3_MHV | Replicase polyprotein 1ab | -7.11 | N/A | N/A | N/A | N/A |
NSP3_SARS2 | Replicase polyprotein 1ab | -7.31 | N/A | N/A | N/A | N/A |
NSP9_HCoV-229E | Replicase polyprotein 1ab | -6.41 | -5.73 | N/A | N/A | N/A |
PA_A-H17N10 | Polymerase acidic protein | -7.06 | N/A | N/A | N/A | N/A |
PA_A-H1N1 | Polymerase acidic protein | -7.41 | -7.73 | -7.78 | N/A | N/A |
PA_A-H5N1 | Polymerase acidic protein | -6.66 | -6.56 | -6.55 | N/A | N/A |
PA_INFA | Polymerase acidic protein | -8.71 | -6.18 | -5.98 | 31.03% | CHEMBL3600947 |
PA_INFB | Polymerase acidic protein | -7.23 | N/A | N/A | N/A | N/A |
PB2_A-H3N2 | Polymerase basic protein 2 | -8.20 | -8.20 | N/A | N/A | N/A |
PB2_A-H5N1 | Polymerase basic protein 2 | -6.53 | -8.09 | -8.35 | N/A | N/A |
PB2_INFB | Polymerase basic protein 2 | -7.76 | N/A | N/A | N/A | N/A |
PB3_A-H3N2 | Polymerase basic protein 2 | -8.26 | N/A | N/A | N/A | N/A |
PB4_A-H3N2 | Polymerase basic protein 2 | -8.03 | N/A | N/A | N/A | N/A |
PLP_SARS | Replicase polyprotein 1a | -8.39 | -8.97 | -7.99 | 35.00% | CHEMBL222735 |
PLP_SARS2 | papain-like protease | -5.61 | N/A | N/A | N/A | N/A |
PM_9VIRU | RNA-directed RNA polymerase L | -8.03 | -7.95 | N/A | N/A | N/A |
PR_FCoV | Replicase polyprotein 1ab | -7.30 | N/A | N/A | 12.58% | CHEMBL4214471 |
PR_HCoV-229E | Replicase polyprotein 1a | -6.14 | -5.78 | N/A | N/A | N/A |
PR_HCoV-NL63 | Replicase polyprotein 1a | -5.21 | -6.17 | N/A | N/A | N/A |
PR_HIV1 | Gag-Pol polyprotein | -6.39 | -6.32 | -6.49 | 16.98% | CHEMBL510485 |
PR_HIV2 | Gag-Pol polyprotein | -6.36 | -6.15 | N/A | N/A | N/A |
PR_HKU1 | Replicase polyprotein 1a | -7.10 | N/A | N/A | N/A | N/A |
PR_HKU4 | Replicase polyprotein 1ab | -6.10 | -6.66 | -6.29 | N/A | N/A |
PR_IBV | Replicase polyprotein 1a | -7.09 | N/A | N/A | N/A | N/A |
PR_MERs | 3C-like proteinase | -6.94 | -6.35 | N/A | N/A | N/A |
PR_PEDV | 3C-like proteinase | -6.25 | N/A | N/A | N/A | N/A |
PR_SARS | Replicase polyprotein 1ab | -7.01 | -6.87 | -6.52 | 36.36% | CHEMBL471187 |
PR_SARS2 | 3C-like protease | -6.92 | N/A | N/A | N/A | N/A |
PR_TGEV | Replicase polyprotein 1a | -6.23 | N/A | N/A | N/A | N/A |
P_9CALI | Norovirus P domain protein | -8.45 | N/A | N/A | N/A | N/A |
P_NVN68 | Capsid protein VP1 | -5.95 | N/A | N/A | N/A | N/A |
RDRP_SARS2 | RNA-dependent RNA polymerase | -5.23 | N/A | N/A | 10.78% | CHEMBL4065616 |
RT_HIV1 | Gag-Pol polyprotein | -9.74 | -9.96 | -10.26 | 19.00% | CHEMBL3775172 |
SPIKE_HCoV-229E | Spike glycoprotein | -4.24 | N/A | N/A | N/A | N/A |
SPIKE_HCoV-NL63 | Spike glycoprotein | -5.26 | N/A | N/A | N/A | N/A |
SPIKE_HCoV-OC43 | Spike glycoprotein | -5.46 | N/A | N/A | N/A | N/A |
SPIKE_HKU4 | Spike glycoprotein | -6.91 | N/A | N/A | N/A | N/A |
SPIKE_IBV | Spike glycoprotein | -5.21 | N/A | N/A | N/A | N/A |
SPIKE_MERs | Spike glycoprotein | -6.09 | -5.10 | -4.90 | N/A | N/A |
SPIKE_MHV | Spike glycoprotein | -6.16 | N/A | N/A | N/A | N/A |
SPIKE_PDCoV | Spike protein | -5.71 | N/A | N/A | N/A | N/A |
SPIKE_SARS | Spike glycoprotein | -5.70 | -5.69 | N/A | N/A | N/A |
SPIKE_SARS2 | Spike glycoprotein | -6.02 | -5.88 | -6.53 | N/A | N/A |
VP1_9CALI | Capsid protein | -7.33 | N/A | N/A | N/A | N/A |
VP1_NVN68 | Capsid protein VP1 | -5.17 | N/A | N/A | N/A | N/A |
VP24_EBORE | Membrane-associated protein VP24 | -5.52 | N/A | N/A | N/A | N/A |
VP24_EBOSU | Membrane-associated protein VP24 | -3.97 | N/A | N/A | N/A | N/A |
VP24_EBOZM | Membrane-associated protein VP24 | -5.07 | N/A | N/A | N/A | N/A |
VP30_9MONO | Minor nucleoprotein VP30 | -5.54 | N/A | N/A | N/A | N/A |
VP30_EBOZ5 | Transcriptional activator VP30 | -6.20 | N/A | N/A | N/A | N/A |
VP30_EBOZM | Transcriptional activator VP30 | -6.29 | N/A | N/A | N/A | N/A |
VP35_EBORR | Polymerase cofactor VP35 | -6.83 | N/A | N/A | N/A | N/A |
VP35_EBOZM | Polymerase cofactor VP35 | -5.12 | -6.87 | -6.82 | N/A | N/A |
VP40_EBOZM | Matrix protein VP40 | -5.58 | -5.36 | N/A | N/A | N/A |