suplatast #60 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACM5_HUMAN

Docking Scores:
-8.71 -8.88 -9.95
Similarity Score:
41.25%
Best Match:
CHEMBL3184335
Prediction Result:
Active72.42%

ACTHR_HUMAN

Docking Scores:
-8.41 -7.88 -6.87
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-8.24 -6.75 -8.36
Similarity Score:
38.58%
Best Match:
CHEMBL142635
Prediction Result:
Inactive67.18%

ADA2A_HUMAN

Docking Scores:
17.84 ? ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

ADA2B_HUMAN

Docking Scores:
-9.48 -8.04 -8.03
Similarity Score:
34.75%
Best Match:
CHEMBL518592
Prediction Result:
Active55.33%

ADA2C_HUMAN

Docking Scores:
15.32 ? ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

ADRB1_HUMAN

Docking Scores:
-8.56 -8.28 -8.93
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
Active60.53%

ADRB2_HUMAN

Docking Scores:
-8.68 -9.20 -9.43
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-8.21 -9.15 -8.15
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.38 -8.63 -8.40
Similarity Score:
28.04%
Best Match:
CHEMBL215160
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-9.36 -9.28 -9.00
Similarity Score:
34.10%
Best Match:
CHEMBL280869
Prediction Result:
Inactive71.59%

CALCR_HUMAN

Docking Scores:
-7.03 -7.84 -8.20
Similarity Score:
27.11%
Best Match:
CHEMBL2369905
Prediction Result:
Inactive98.12%

CCKAR_HUMAN

Docking Scores:
-8.06 -7.86 -9.01
Similarity Score:
35.03%
Best Match:
CHEMBL357983
Prediction Result:
Inactive93.05%

CCR1_HUMAN

Docking Scores:
-7.73 -7.71 -7.45
Similarity Score:
39.60%
Best Match:
CHEMBL2208416
Prediction Result:
Inactive93.22%

CCR2_HUMAN

Docking Scores:
-7.02 -7.34 -8.03
Similarity Score:
37.14%
Best Match:
CHEMBL246313
Prediction Result:
Inactive90.54%

CCR4_HUMAN

Docking Scores:
-7.09 -7.74 -8.61
Similarity Score:
31.28%
Best Match:
CHEMBL64391
Prediction Result:
Inactive72.48%

CCR5_HUMAN

Docking Scores:
-8.72 -7.86 -7.38
Similarity Score:
40.69%
Best Match:
CHEMBL370552
Prediction Result:
Inactive95.86%

CLTR1_HUMAN

Docking Scores:
-8.62 -9.34 -8.99
Similarity Score:
38.69%
Best Match:
CHEMBL3342949
Prediction Result:
Inactive85.60%

CNR1_HUMAN

Docking Scores:
-8.43 -8.90 -8.47
Similarity Score:
43.37%
Best Match:
CHEMBL410337
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-10.01 -9.14
Similarity Score:
42.14%
Best Match:
CHEMBL466402
Prediction Result:
N/A