Job 1 #318 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Cocaine
ACM5_HUMAN

Docking Scores:
-8.80 -8.62 -7.78
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
Active88.89%

L: Tramadol
ACM5_HUMAN

Docking Scores:
-7.73 -7.80 -7.74
Similarity Score:
73.68%
Best Match:
CHEMBL1490
Prediction Result:
Active93.60%

L: Cocaine
ACTHR_HUMAN

Docking Scores:
-8.85 -8.73 -7.86
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

L: Tramadol
ACTHR_HUMAN

Docking Scores:
-7.43 -7.21 -7.67
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

L: Cocaine
ADA1D_HUMAN

Docking Scores:
-7.80 -8.23 -7.61
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
Active85.55%

L: Tramadol
ADA1D_HUMAN

Docking Scores:
-6.68 -7.48 -7.33
Similarity Score:
56.67%
Best Match:
CHEMBL282214
Prediction Result:
Active77.82%

L: Cocaine
ADA2A_HUMAN

Docking Scores:
-5.67 -7.53 -5.27
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
Active84.99%

L: Tramadol
ADA2A_HUMAN

Docking Scores:
-5.94 -7.36 -5.12
Similarity Score:
59.14%
Best Match:
CHEMBL6966
Prediction Result:
Active84.58%

L: Cocaine
ADA2B_HUMAN

Docking Scores:
-9.01 -8.91 -8.58
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
Active85.06%

L: Tramadol
ADA2B_HUMAN

Docking Scores:
-8.93 -8.39 -8.44
Similarity Score:
56.04%
Best Match:
CHEMBL41
Prediction Result:
Active77.58%

L: Cocaine
ADA2C_HUMAN

Docking Scores:
-3.87 -3.91 -3.49
Similarity Score:
65.62%
Best Match:
CHEMBL1201203
Prediction Result:
Inactive99.99%

L: Tramadol
ADA2C_HUMAN

Docking Scores:
-3.00 -3.03 -2.20
Similarity Score:
59.22%
Best Match:
CHEMBL476839
Prediction Result:
Inactive99.99%

L: Cocaine
ADRB1_HUMAN

Docking Scores:
-8.13 -8.21 -7.72
Similarity Score:
45.90%
Best Match:
CHEMBL1085395
Prediction Result:
Active65.97%

L: Tramadol
ADRB1_HUMAN

Docking Scores:
-7.54 -7.30 -7.10
Similarity Score:
55.10%
Best Match:
CHEMBL1263
Prediction Result:
Active83.66%

L: Cocaine
ADRB2_HUMAN

Docking Scores:
-7.78 -8.91 -8.38
Similarity Score:
49.60%
Best Match:
CHEMBL1459608
Prediction Result:
N/A

L: Tramadol
ADRB2_HUMAN

Docking Scores:
-7.01 -7.56 -7.51
Similarity Score:
60.67%
Best Match:
CHEMBL3099663
Prediction Result:
N/A

L: Cocaine
ADRB3_HUMAN

Docking Scores:
-7.94 -8.46 -7.73
Similarity Score:
49.23%
Best Match:
CHEMBL3746885
Prediction Result:
N/A

L: Tramadol
ADRB3_HUMAN

Docking Scores:
-7.75 -7.37 -7.73
Similarity Score:
54.84%
Best Match:
CHEMBL12994
Prediction Result:
N/A

L: Cocaine
AGTR2_HUMAN

Docking Scores:
-7.39 -7.57 -7.30
Similarity Score:
32.61%
Best Match:
CHEMBL376286
Prediction Result:
N/A

L: Tramadol
AGTR2_HUMAN

Docking Scores:
-7.03 -6.96 -7.03
Similarity Score:
38.89%
Best Match:
CHEMBL154057
Prediction Result:
N/A