Anti-pain drug nv1 #225 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Icatibant
AA1R_HUMAN

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?

L: Nefazodone
AA1R_HUMAN

Docking Scores:
-9.12 -8.62 -7.93
Similarity Score:
38.29%
Best Match:
CHEMBL275427

L: Balsalazide
AA1R_HUMAN

Docking Scores:
-8.57 -8.59 -8.04
Similarity Score:
40.82%
Best Match:
CHEMBL371131

L: Alfentanil
AA1R_HUMAN

Docking Scores:
-7.54 -7.79 -7.69
Similarity Score:
33.33%
Best Match:
CHEMBL4065629

L: Carbamoylcholine
AA1R_HUMAN

Docking Scores:
-3.91 -3.79 -4.28
Similarity Score:
15.00%
Best Match:
CHEMBL3350613

L: Icatibant
AA2AR_HUMAN

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?

L: Nefazodone
AA2AR_HUMAN

Docking Scores:
-8.97 -9.08 -8.31
Similarity Score:
38.96%
Best Match:
CHEMBL246468

L: Balsalazide
AA2AR_HUMAN

Docking Scores:
-8.51 -8.48 -8.76
Similarity Score:
41.55%
Best Match:
CHEMBL194860

L: Alfentanil
AA2AR_HUMAN

Docking Scores:
-7.42 -7.28 -8.12
Similarity Score:
35.45%
Best Match:
CHEMBL554840

L: Carbamoylcholine
AA2AR_HUMAN

Docking Scores:
-4.12 -4.07 -4.08
Similarity Score:
15.00%
Best Match:
CHEMBL3350613

L: Icatibant
ACES_HUMAN

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?

L: Nefazodone
ACES_HUMAN

Docking Scores:
-10.18 -9.07 -9.95
Similarity Score:
34.25%
Best Match:
CHEMBL3632988

L: Balsalazide
ACES_HUMAN

Docking Scores:
-8.53 -8.92 -7.97
Similarity Score:
43.97%
Best Match:
CHEMBL139353

L: Alfentanil
ACES_HUMAN

Docking Scores:
-9.09 -8.79 -6.61
Similarity Score:
38.46%
Best Match:
CHEMBL141853

L: Carbamoylcholine
ACES_HUMAN

Docking Scores:
-4.64 -4.45 -4.81
Similarity Score:
32.69%
Best Match:
CHEMBL366931

L: Icatibant
ACE_HUMAN

Docking Scores:
-8.84 ? ?
Similarity Score:
?
Best Match:
?

L: Nefazodone
ACE_HUMAN

Docking Scores:
-9.33 -8.80 -7.54
Similarity Score:
32.86%
Best Match:
CHEMBL3414814

L: Balsalazide
ACE_HUMAN

Docking Scores:
-8.87 -8.34 -8.00
Similarity Score:
41.98%
Best Match:
CHEMBL2112767

L: Alfentanil
ACE_HUMAN

Docking Scores:
-7.98 -8.77 -7.54
Similarity Score:
43.88%
Best Match:
CHEMBL78731

L: Carbamoylcholine
ACE_HUMAN

Docking Scores:
-4.46 -4.33 -4.29
Similarity Score:
23.53%
Best Match:
CHEMBL78440