Atazanavir #169 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match
Model 1 Model 2 Model 3
GP160_HIV1 Envelope glycoprotein gp160 -7.58 -7.77 -7.46 N/A N/A
GP160_HIV2 Envelope glycoprotein gp160 -6.69 N/A N/A N/A N/A
GP_EBOV Envelope glycoprotein -7.76 -8.38 -7.56 35.56% CHEMBL3125895
HA_A-H10N7 Hemagglutinin -6.72 N/A N/A N/A N/A
HA_A-H10N8 Hemagglutinin -6.64 N/A N/A N/A N/A
HA_A-H13N6 Hemagglutinin -6.63 N/A N/A N/A N/A
HA_A-H14N6 Hemagglutinin -6.21 N/A N/A N/A N/A
HA_A-H15N9 Hemagglutinin -6.02 N/A N/A N/A N/A
HA_A-H17N10 Hemagglutinin -6.05 N/A N/A N/A N/A
HA_A-H18N11 Hemagglutinin -5.61 N/A N/A N/A N/A
HA_A-H1N1 Hemagglutinin -6.88 -6.37 N/A N/A N/A
HA_A-H2N2 Hemagglutinin -6.60 -5.81 N/A N/A N/A
HA_A-H3N2 Hemagglutinin -6.94 -5.82 -6.25 N/A N/A
HA_A-H3N8 Hemagglutinin -5.72 -6.01 -6.73 N/A N/A
HA_A-H5N1 Hemagglutinin -6.23 -6.62 -6.40 N/A N/A
HA_A-H5N3 Hemagglutinin -6.13 -5.82 N/A N/A N/A
HA_A-H6N1 Hemagglutinin -6.64 N/A N/A N/A N/A
HA_A-H6N6 Hemagglutinin -6.69 N/A N/A N/A N/A
HA_A-H7N2 Hemagglutinin -6.13 -5.88 -6.32 N/A N/A
HA_A-H7N7 Hemagglutinin -6.02 -6.80 N/A N/A N/A
HA_A-H7N9 Hemagglutinin -7.39 N/A N/A N/A N/A
HA_INFB Hemagglutinin -6.13 -6.57 N/A N/A N/A
HA_INFD Hemagglutinin-esterase-fusion glycoprotein -5.66 N/A N/A N/A N/A
HE_BCV Hemagglutinin-esterase -7.11 -6.85 N/A N/A N/A
HE_HCoV-OC43 Hemagglutinin-esterase -5.11 N/A N/A N/A N/A
HE_MHV Hemagglutinin-esterase -6.01 N/A N/A N/A N/A
IN_HIV1 Gag-Pol polyprotein -6.14 -5.75 N/A N/A N/A
MD_HKU4 Replicase polyprotein 1ab -7.58 -7.76 -7.68 N/A N/A
MD_MERs Replicase polyprotein 1a -7.61 -7.91 N/A N/A N/A
MX2_A-H5N1 Matrix protein 2 9.91 N/A N/A N/A N/A
NA_A-H11N6 Neuraminidase -7.69 -8.04 -7.28 N/A N/A
NA_A-H11N9 Neuraminidase -5.75 -8.06 -7.96 N/A N/A
NA_A-H12N5 Neuraminidase -7.60 -7.41 -7.65 N/A N/A
NA_A-H13N9 Neuraminidase -5.77 N/A N/A N/A N/A
NA_A-H17N10 Neuraminidase -6.96 N/A N/A N/A N/A
NA_A-H18N11 Neuraminidase -6.81 N/A N/A N/A N/A
NA_A-H1N1 Neuraminidase -9.01 N/A N/A N/A N/A
NA_A-H2N2 Neuraminidase -7.73 -7.82 -8.88 N/A N/A
NA_A-H3N2 Ig heavy chain Mem5 -7.94 -6.89 N/A N/A N/A
NA_A-H3N8 Neuraminidase -7.75 -9.17 -7.17 N/A N/A
NA_A-H5N1 Neuraminidase -9.21 N/A N/A N/A N/A
NA_A-H7N9 Neuraminidase -7.63 -7.55 -7.93 N/A N/A
NA_INFB Neuraminidase -7.35 -8.00 N/A 34.26% CHEMBL318452
NP_A-H1N1 Nucleoprotein -5.82 -7.11 -6.90 N/A N/A
NP_A-H5N1 Nucleoprotein -6.91 N/A N/A N/A N/A
NP_HCoV-NL63 Nucleoprotein -7.14 N/A N/A N/A N/A
NP_HCoV-OC43 Nucleoprotein -8.15 -6.44 -6.97 21.81% CHEMBL3233481
NP_INFB Nucleoprotein -5.29 N/A N/A N/A N/A
NP_INFD NP -4.85 N/A N/A N/A N/A
NP_SARS Nucleoprotein -6.83 N/A N/A N/A N/A
NS3_HCV1A Genome polyprotein -6.57 -5.74 -6.30 40.54% CHEMBL3976363
NS3_HCV1B Genome polyprotein -9.43 -6.06 -6.12 42.59% CHEMBL1170408
NS3_HCV3A Genome polyprotein -6.95 -6.24 -6.50 N/A N/A
NS5B_HCV1A Genome polyprotein -8.28 -9.45 -9.42 43.21% CHEMBL353549
NS5B_HCV1B Genome polyprotein -8.27 -8.92 -8.44 36.65% CHEMBL3422106
NS5B_HCV2A Genome polyprotein -9.61 -6.02 N/A N/A N/A
NSP15_SARS Replicase polyprotein 1ab -6.33 N/A N/A 42.79% CHEMBL2441745
NSP1_INFB Non-structural protein 1 -6.26 -6.14 N/A N/A N/A
NSP1_SARS Replicase polyprotein 1ab -6.38 N/A N/A 42.79% CHEMBL2441745
NSP3_HCoV-229E Replicase polyprotein 1a -7.70 N/A N/A N/A N/A
NSP3_IBV Replicase polyprotein 1a -6.45 N/A N/A N/A N/A
NSP3_MHV Replicase polyprotein 1ab -6.69 N/A N/A N/A N/A
NSP9_HCoV-229E Replicase polyprotein 1ab -6.51 -5.82 N/A N/A N/A
PA_A-H17N10 Polymerase acidic protein -7.98 N/A N/A N/A N/A
PA_A-H1N1 Polymerase acidic protein -9.03 -8.27 -8.20 N/A N/A
PA_A-H5N1 Polymerase acidic protein -8.50 -7.38 -8.78 N/A N/A
PA_INFA Polymerase acidic protein -9.05 -8.02 -8.65 30.61% CHEMBL463590
PA_INFB Polymerase acidic protein -7.58 N/A N/A N/A N/A
PB2_A-H3N2 Polymerase basic protein 2 -7.31 -7.26 N/A N/A N/A
PB2_A-H5N1 Polymerase basic protein 2 -7.50 -8.16 -7.47 N/A N/A
PB2_INFB Polymerase basic protein 2 -7.62 N/A N/A N/A N/A
PB3_A-H3N2 Polymerase basic protein 2 -7.64 N/A N/A N/A N/A
PB4_A-H3N2 Polymerase basic protein 2 -7.22 N/A N/A N/A N/A
PLP_SARS Replicase polyprotein 1a -8.63 -9.85 -9.63 35.41% CHEMBL213054
PR_FCoV Replicase polyprotein 1ab -7.27 N/A N/A N/A N/A
PR_HCoV-229E Replicase polyprotein 1a -7.18 -6.87 N/A N/A N/A
PR_HCoV-NL63 Replicase polyprotein 1a -4.60 -7.29 N/A N/A N/A
PR_HIV1 Gag-Pol polyprotein -6.47 -5.90 -6.29 33.48% CHEMBL510485
PR_HIV2 Gag-Pol polyprotein -6.36 -6.57 N/A N/A N/A
PR_HKU1 Replicase polyprotein 1a -7.57 N/A N/A N/A N/A
PR_HKU4 Replicase polyprotein 1ab -6.20 -6.68 -6.75 N/A N/A
PR_IBV Replicase polyprotein 1a -7.61 N/A N/A N/A N/A
PR_MERs 3C-like proteinase -6.47 -7.85 N/A N/A N/A
PR_PEDV 3C-like proteinase -6.93 N/A N/A N/A N/A
PR_SARS Replicase polyprotein 1ab -7.63 -7.36 -7.42 42.79% CHEMBL2441745
PR_SARS2 3C-like protease -7.83 N/A N/A N/A N/A
PR_TGEV Replicase polyprotein 1a -7.61 N/A N/A N/A N/A
RT_HIV1 Gag-Pol polyprotein -8.45 -8.98 -8.01 43.54% CHEMBL4110612
SPIKE_HCoV-229E Spike glycoprotein -4.89 N/A N/A N/A N/A
SPIKE_HCoV-NL63 Spike glycoprotein -6.12 N/A N/A N/A N/A
SPIKE_HCoV-OC43 Spike glycoprotein -6.56 N/A N/A N/A N/A
SPIKE_HKU4 Spike glycoprotein -5.89 N/A N/A N/A N/A
SPIKE_IBV Spike glycoprotein -5.47 N/A N/A N/A N/A
SPIKE_MERs Spike glycoprotein -6.18 -6.74 -5.20 N/A N/A
SPIKE_MHV Spike glycoprotein -6.42 N/A N/A N/A N/A
SPIKE_PDCoV Spike protein -6.16 N/A N/A N/A N/A
SPIKE_SARS Spike glycoprotein -5.97 -5.68 N/A N/A N/A
SPIKE_SARS2 Spike glycoprotein -5.69 N/A N/A N/A N/A