Captagon #30 Output Download CSV

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

Docking Scores:
-9.18 -8.73 -9.30
Similarity Score:
58.57%
Best Match:
CHEMBL1200406
Prediction Result:
Active67.33%

ACTHR_HUMAN

Docking Scores:
-9.88 -9.37 -8.33
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-7.98 -8.52 -7.98
Similarity Score:
49.08%
Best Match:
CHEMBL219719
Prediction Result:
Inactive54.75%

ADA2A_HUMAN

Docking Scores:
-7.79 -8.61 -2.85
Similarity Score:
43.26%
Best Match:
CHEMBL40650
Prediction Result:
Inactive99.99%

ADA2B_HUMAN

Docking Scores:
-9.56 -9.02 -9.43
Similarity Score:
43.71%
Best Match:
CHEMBL51433
Prediction Result:
Active75.08%

ADA2C_HUMAN

Docking Scores:
-4.49 -2.75 -2.53
Similarity Score:
43.26%
Best Match:
CHEMBL40650
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-9.20 -8.39 -8.65
Similarity Score:
48.78%
Best Match:
CHEMBL1814267
Prediction Result:
Active52.89%

ADRB2_HUMAN

Docking Scores:
-9.07 -9.73 -9.31
Similarity Score:
55.19%
Best Match:
CHEMBL462313
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-9.24 -10.15 -9.02
Similarity Score:
55.03%
Best Match:
CHEMBL3764950
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.83 -8.81 -8.36
Similarity Score:
43.45%
Best Match:
CHEMBL219840
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-7.95 -8.72 -8.72
Similarity Score:
35.40%
Best Match:
CHEMBL2392354
Prediction Result:
Inactive72.12%

CALCR_HUMAN

Docking Scores:
-7.52 -7.72 -7.94
Similarity Score:
30.00%
Best Match:
CHEMBL2369907
Prediction Result:
Inactive98.24%

CCKAR_HUMAN

Docking Scores:
-8.01 -8.76 -9.07
Similarity Score:
32.55%
Best Match:
CHEMBL1172252
Prediction Result:
Inactive83.94%

CCR1_HUMAN

Docking Scores:
-7.81 -9.36 -7.61
Similarity Score:
37.20%
Best Match:
CHEMBL69411
Prediction Result:
Inactive91.52%

CCR2_HUMAN

Docking Scores:
-8.19 -7.82 -7.38
Similarity Score:
37.80%
Best Match:
CHEMBL1951773
Prediction Result:
Inactive78.92%

CCR4_HUMAN

Docking Scores:
-7.60 -8.01 -8.71
Similarity Score:
42.21%
Best Match:
CHEMBL232840
Prediction Result:
Inactive64.33%

CCR5_HUMAN

Docking Scores:
-8.13 -8.17 -8.23
Similarity Score:
51.37%
Best Match:
CHEMBL195199
Prediction Result:
Inactive85.40%

CLTR1_HUMAN

Docking Scores:
-8.44 -10.03 -9.08
Similarity Score:
28.98%
Best Match:
CHEMBL423333
Prediction Result:
Inactive84.96%

CNR1_HUMAN

Docking Scores:
-7.62 -9.18 -10.14
Similarity Score:
41.83%
Best Match:
CHEMBL527071
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-9.35 -9.55
Similarity Score:
55.40%
Best Match:
CHEMBL4096536
Prediction Result:
N/A