Job 1 #318 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Cocaine
HRH1_HUMAN

Docking Scores:
-7.05
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
N/A

L: Tramadol
HRH1_HUMAN

Docking Scores:
-7.03
Similarity Score:
59.22%
Best Match:
CHEMBL476839
Prediction Result:
N/A

L: Cocaine
HRH2_HUMAN

Docking Scores:
-8.46 -8.04 -7.50
Similarity Score:
55.66%
Best Match:
CHEMBL1626
Prediction Result:
Active97.92%

L: Tramadol
HRH2_HUMAN

Docking Scores:
-8.45 -7.44 -6.59
Similarity Score:
58.06%
Best Match:
CHEMBL2205811
Prediction Result:
Active87.10%

L: Cocaine
HRH3_HUMAN

Docking Scores:
-6.62 -7.93 -7.93
Similarity Score:
55.28%
Best Match:
CHEMBL514217
Prediction Result:
Active75.73%

L: Tramadol
HRH3_HUMAN

Docking Scores:
-6.63 -7.37 -7.43
Similarity Score:
70.93%
Best Match:
CHEMBL2375598
Prediction Result:
Active98.26%

L: Cocaine
HRH4_HUMAN

Docking Scores:
-8.08 -7.61 -7.92
Similarity Score:
53.23%
Best Match:
CHEMBL4083336
Prediction Result:
Active84.88%

L: Tramadol
HRH4_HUMAN

Docking Scores:
-7.30 -7.26 -7.50
Similarity Score:
48.57%
Best Match:
CHEMBL1934062
Prediction Result:
Active82.03%

L: Cocaine
MC3R_HUMAN

Docking Scores:
-7.45 -6.85 -7.33
Similarity Score:
47.83%
Best Match:
CHEMBL379879
Prediction Result:
Inactive54.03%

L: Tramadol
MC3R_HUMAN

Docking Scores:
-7.36 -6.66 -6.13
Similarity Score:
41.67%
Best Match:
CHEMBL363019
Prediction Result:
Inactive62.21%

L: Cocaine
MC4R_HUMAN

Docking Scores:
-6.60 -6.03 -6.33
Similarity Score:
47.83%
Best Match:
CHEMBL379879
Prediction Result:
Inactive66.76%

L: Tramadol
MC4R_HUMAN

Docking Scores:
-6.47 -5.85 -5.54
Similarity Score:
47.56%
Best Match:
CHEMBL195998
Prediction Result:
Inactive70.60%

L: Cocaine
MC5R_HUMAN

Docking Scores:
-5.88 -6.82 -3.96
Similarity Score:
37.21%
Best Match:
CHEMBL1209788
Prediction Result:
Inactive99.99%

L: Tramadol
MC5R_HUMAN

Docking Scores:
-5.69 -7.55 -4.69
Similarity Score:
41.67%
Best Match:
CHEMBL363019
Prediction Result:
Inactive80.79%

L: Cocaine
MSHR_HUMAN

Docking Scores:
-7.54 -6.87 -7.12
Similarity Score:
47.83%
Best Match:
CHEMBL379879
Prediction Result:
Inactive58.40%

L: Tramadol
MSHR_HUMAN

Docking Scores:
-6.69 -6.15 -6.52
Similarity Score:
40.14%
Best Match:
CHEMBL276301
Prediction Result:
Inactive61.61%

L: Cocaine
NK1R_HUMAN

Docking Scores:
-7.63 -8.02 -7.15
Similarity Score:
54.84%
Best Match:
CHEMBL2115009
Prediction Result:
N/A

L: Tramadol
NK1R_HUMAN

Docking Scores:
-7.02 -7.40 -7.28
Similarity Score:
58.16%
Best Match:
CHEMBL140101
Prediction Result:
N/A

L: Cocaine
NK2R_HUMAN

Docking Scores:
-7.63 -7.44 -7.45
Similarity Score:
56.60%
Best Match:
CHEMBL305660
Prediction Result:
Inactive94.45%

L: Tramadol
NK2R_HUMAN

Docking Scores:
-6.72 -7.09 -6.97
Similarity Score:
52.38%
Best Match:
CHEMBL17157
Prediction Result:
Inactive98.57%