Anti-pain drug nv1 #225 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Icatibant
ADRB2_HUMAN

Docking Scores:
-5.05 -3.26 -1.91
Similarity Score:
42.45%
Best Match:
CHEMBL1814275

L: Nefazodone
ADRB2_HUMAN

Docking Scores:
-8.92 -9.45 -9.77
Similarity Score:
42.86%
Best Match:
CHEMBL199824

L: Balsalazide
ADRB2_HUMAN

Docking Scores:
-9.14 -9.49 -9.49
Similarity Score:
46.92%
Best Match:
CHEMBL1459608

L: Alfentanil
ADRB2_HUMAN

Docking Scores:
-7.60 -8.62 -8.44
Similarity Score:
40.40%
Best Match:
CHEMBL1459608

L: Carbamoylcholine
ADRB2_HUMAN

Docking Scores:
-4.88 -4.27 -4.24
Similarity Score:
23.81%
Best Match:
CHEMBL4062049

L: Icatibant
AGTR2_HUMAN

Docking Scores:
-9.05 -10.27 -8.75
Similarity Score:
54.30%
Best Match:
CHEMBL3350599

L: Nefazodone
AGTR2_HUMAN

Docking Scores:
-9.13 -9.40 -8.82
Similarity Score:
33.10%
Best Match:
CHEMBL125760

L: Balsalazide
AGTR2_HUMAN

Docking Scores:
-8.08 -8.06 -7.96
Similarity Score:
36.50%
Best Match:
CHEMBL376286

L: Alfentanil
AGTR2_HUMAN

Docking Scores:
-7.79 -8.13 -7.90
Similarity Score:
34.50%
Best Match:
CHEMBL348157

L: Carbamoylcholine
AGTR2_HUMAN

Docking Scores:
-3.89 -4.11 -3.83
Similarity Score:
14.71%
Best Match:
CHEMBL290829

L: Icatibant
ALDR_HUMAN

Docking Scores:
0.05 -4.62 -5.98
Similarity Score:
41.90%
Best Match:
CHEMBL10382

L: Nefazodone
ALDR_HUMAN

Docking Scores:
-9.04 -8.72 -9.15
Similarity Score:
38.07%
Best Match:
CHEMBL143633

L: Balsalazide
ALDR_HUMAN

Docking Scores:
-9.13 -9.16 -8.73
Similarity Score:
39.16%
Best Match:
CHEMBL414208

L: Alfentanil
ALDR_HUMAN

Docking Scores:
-8.03 -7.79 -7.50
Similarity Score:
34.50%
Best Match:
CHEMBL344057

L: Carbamoylcholine
ALDR_HUMAN

Docking Scores:
-4.86 -4.80 -4.89
Similarity Score:
16.47%
Best Match:
CHEMBL436

L: Icatibant
AMPN_HUMAN

Docking Scores:
-9.32 -9.74 -9.10
Similarity Score:
62.64%
Best Match:
CHEMBL1077590

L: Nefazodone
AMPN_HUMAN

Docking Scores:
-8.50 -9.11 -7.93
Similarity Score:
30.94%
Best Match:
CHEMBL328470

L: Balsalazide
AMPN_HUMAN

Docking Scores:
-8.99 -8.25 -8.43
Similarity Score:
30.50%
Best Match:
CHEMBL2204950

L: Alfentanil
AMPN_HUMAN

Docking Scores:
-7.96 -8.07 -7.95
Similarity Score:
38.10%
Best Match:
CHEMBL328470

L: Carbamoylcholine
AMPN_HUMAN

Docking Scores:
-4.04 -4.42 -4.46
Similarity Score:
26.67%
Best Match:
CHEMBL3298947