LTJ #73 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Dihydrocodeine
OPRX_HUMAN

Docking Scores:
-7.74 -7.66 -7.49
Similarity Score:
94.85%
Best Match:
CHEMBL511142

L: Acetylsalicylic acid
OPRX_HUMAN

Docking Scores:
-5.82 -5.74 -5.84
Similarity Score:
35.00%
Best Match:
CHEMBL201805

L: Hydromorphone
OPRX_HUMAN

Docking Scores:
-7.74 -7.90 -7.38
Similarity Score:
78.29%
Best Match:
CHEMBL511142

L: Ibuprofen
OPRX_HUMAN

Docking Scores:
-6.35 -6.38 -6.89
Similarity Score:
41.86%
Best Match:
CHEMBL186300

L: Codeine
OPRX_HUMAN

Docking Scores:
-7.36 -7.39 -7.38
Similarity Score:
93.85%
Best Match:
CHEMBL3262362

L: Dihydrocodeine
P2RX3_HUMAN

Docking Scores:
-6.24 -5.43 -6.37
Similarity Score:
34.78%
Best Match:
CHEMBL3679847

L: Acetylsalicylic acid
P2RX3_HUMAN

Docking Scores:
-5.33 -4.52 -4.69
Similarity Score:
28.57%
Best Match:
CHEMBL3919713

L: Hydromorphone
P2RX3_HUMAN

Docking Scores:
-6.22 -6.52 -6.34
Similarity Score:
39.02%
Best Match:
CHEMBL3679847

L: Ibuprofen
P2RX3_HUMAN

Docking Scores:
-4.85 -4.65 -5.29
Similarity Score:
23.86%
Best Match:
CHEMBL2180149

L: Codeine
P2RX3_HUMAN

Docking Scores:
-6.03 -5.85 -5.83
Similarity Score:
35.32%
Best Match:
CHEMBL3679847

L: Dihydrocodeine
P2Y12_HUMAN

Docking Scores:
-7.67 -5.18 -6.30
Similarity Score:
33.33%
Best Match:
CHEMBL92264

L: Acetylsalicylic acid
P2Y12_HUMAN

Docking Scores:
-6.87 -6.37 -6.94
Similarity Score:
33.64%
Best Match:
CHEMBL327374

L: Hydromorphone
P2Y12_HUMAN

Docking Scores:
-7.56 -4.70 -6.18
Similarity Score:
35.87%
Best Match:
CHEMBL92264

L: Ibuprofen
P2Y12_HUMAN

Docking Scores:
-7.79 -8.09 -8.16
Similarity Score:
35.11%
Best Match:
CHEMBL91127

L: Codeine
P2Y12_HUMAN

Docking Scores:
-7.26 -3.78 -5.99
Similarity Score:
28.38%
Best Match:
CHEMBL2172277

L: Dihydrocodeine
PAR1_HUMAN

Docking Scores:
-8.42
Similarity Score:
35.71%
Best Match:
CHEMBL80942

L: Acetylsalicylic acid
PAR1_HUMAN

Docking Scores:
-7.46
Similarity Score:
30.00%
Best Match:
CHEMBL2048425

L: Hydromorphone
PAR1_HUMAN

Docking Scores:
-9.79
Similarity Score:
39.78%
Best Match:
CHEMBL80942

L: Ibuprofen
PAR1_HUMAN

Docking Scores:
-7.30
Similarity Score:
30.59%
Best Match:
CHEMBL3658406

L: Codeine
PAR1_HUMAN

Docking Scores:
-9.19
Similarity Score:
34.22%
Best Match:
CHEMBL3086083