gh #495 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

OPRX_HUMAN

Docking Scores:
-7.26 -7.36 -7.15
Similarity Score:
34.92%
Best Match:
CHEMBL3919659

P2RX3_HUMAN

Docking Scores:
-5.56 -5.47 -6.06
Similarity Score:
36.77%
Best Match:
CHEMBL290814

P2Y12_HUMAN

Docking Scores:
-6.89 -7.29 -7.28
Similarity Score:
26.11%
Best Match:
CHEMBL420980

PAR1_HUMAN

Docking Scores:
-6.69
Similarity Score:
35.00%
Best Match:
CHEMBL234690

PDE4B_HUMAN

Docking Scores:
-7.74 -7.75 -8.38
Similarity Score:
40.44%
Best Match:
CHEMBL511115

PDE5A_HUMAN

Docking Scores:
-7.98 -7.47 -7.50
Similarity Score:
32.52%
Best Match:
CHEMBL190423

PERM_HUMAN

Docking Scores:
-7.48 -7.56 -7.51
Similarity Score:
26.36%
Best Match:
CHEMBL3920217

PGH1_SHEEP

Docking Scores:
-5.93 -7.56 -5.95
Similarity Score:
34.38%
Best Match:
CHEMBL3400659

PGH2_HUMAN

Docking Scores:
-1.30 -6.23 -6.73
Similarity Score:
37.50%
Best Match:
CHEMBL374130

PPAP_HUMAN

Docking Scores:
-7.54 -7.85
Similarity Score:
23.18%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-7.59 -8.01 -8.49
Similarity Score:
44.44%
Best Match:
CHEMBL4460072

PRGR_HUMAN

Docking Scores:
-7.24 -6.65 -8.52
Similarity Score:
54.81%
Best Match:
CHEMBL221686

PTGES_HUMAN

Docking Scores:
-6.82
Similarity Score:
47.55%
Best Match:
CHEMBL445599

SC6A4_HUMAN

Docking Scores:
-8.63 -8.89 -9.05
Similarity Score:
40.65%
Best Match:
CHEMBL1201151

SCN9A_HUMAN

Docking Scores:
-7.27
Similarity Score:
41.01%
Best Match:
CHEMBL203185

TLR4_HUMAN

Docking Scores:
-7.49 -7.15 -7.52
Similarity Score:
33.13%
Best Match:
CHEMBL4071705

TNFA_HUMAN

Docking Scores:
-7.30 -7.40 -5.56
Similarity Score:
34.60%
Best Match:
CHEMBL2337623

TRBM_HUMAN

Docking Scores:
-6.51 -7.18
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-7.03 -6.41
Similarity Score:
17.24%
Best Match:
CHEMBL1408302

TRPM8_FICAL

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A