Non anti-pain drug v3 #219 Output Download CSV

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  The docking scores are in the AutoDock Vina metric.
L: Canagliflozin
CXCR1_HUMAN

Docking Scores:
0.47
Similarity Score:
25.30%
Best Match:
CHEMBL464012

L: Metformin
CXCR1_HUMAN

Docking Scores:
-6.02
Similarity Score:
7.58%
Best Match:
CHEMBL184637

L: Glimepiride
CXCR1_HUMAN

Docking Scores:
1.20
Similarity Score:
33.49%
Best Match:
CHEMBL387136

L: Glipizide
CXCR1_HUMAN

Docking Scores:
1.21
Similarity Score:
32.18%
Best Match:
CHEMBL3609013

L: Sitagliptin
CXCR1_HUMAN

Docking Scores:
-6.29
Similarity Score:
28.33%
Best Match:
CHEMBL402076

L: Canagliflozin
CXCR4_HUMAN

Docking Scores:
-9.46 -8.24 -8.85
Similarity Score:
24.68%
Best Match:
CHEMBL1644085

L: Metformin
CXCR4_HUMAN

Docking Scores:
-5.15 -5.29 -5.18
Similarity Score:
12.31%
Best Match:
CHEMBL2347630

L: Glimepiride
CXCR4_HUMAN

Docking Scores:
-11.34 -9.07 -9.06
Similarity Score:
40.88%
Best Match:
CHEMBL2029611

L: Glipizide
CXCR4_HUMAN

Docking Scores:
-9.66 -8.06 -7.96
Similarity Score:
41.29%
Best Match:
CHEMBL568245

L: Sitagliptin
CXCR4_HUMAN

Docking Scores:
-9.79 -7.67 -8.66
Similarity Score:
36.22%
Best Match:
CHEMBL1949884

L: Canagliflozin
DRD2_HUMAN

Docking Scores:
-10.10
Similarity Score:
37.44%
Best Match:
CHEMBL597900

L: Metformin
DRD2_HUMAN

Docking Scores:
-5.14
Similarity Score:
13.24%
Best Match:
CHEMBL132575

L: Glimepiride
DRD2_HUMAN

Docking Scores:
-10.59
Similarity Score:
47.97%
Best Match:
CHEMBL1224698

L: Glipizide
DRD2_HUMAN

Docking Scores:
-9.83
Similarity Score:
44.79%
Best Match:
CHEMBL388247

L: Sitagliptin
DRD2_HUMAN

Docking Scores:
-9.97
Similarity Score:
42.77%
Best Match:
CHEMBL122165

L: Canagliflozin
DRD3_HUMAN

Docking Scores:
-9.48
Similarity Score:
37.44%
Best Match:
CHEMBL102414

L: Metformin
DRD3_HUMAN

Docking Scores:
-4.97
Similarity Score:
7.59%
Best Match:
CHEMBL552366

L: Glimepiride
DRD3_HUMAN

Docking Scores:
-10.44
Similarity Score:
47.97%
Best Match:
CHEMBL1224698

L: Glipizide
DRD3_HUMAN

Docking Scores:
-9.85
Similarity Score:
44.79%
Best Match:
CHEMBL388247

L: Sitagliptin
DRD3_HUMAN

Docking Scores:
-9.62
Similarity Score:
37.85%
Best Match:
CHEMBL113956