Trequinsin_BBB #453 Output - DAKB-GPCRS

We use cookies to improve your website experience and to gain insights into our websites' users, traffic and traffic providers to make it even better. You consent to our cookies if you continue to use our website.

Trequinsin_BBB #453 Output Download CSV

View All

Gene Protein

The docking scores are in the AutoDock Vina metric.

HRH1_HUMAN

Docking Scores:
-3.80
Similarity Score:
35.14%
Best Match:
CHEMBL97240
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-9.24 -10.22 -9.67
Similarity Score:
34.14%
Best Match:
CHEMBL4452406
Prediction Result:
Active^95.25%

HRH3_HUMAN

Docking Scores:
-6.86 -9.29 -9.45
Similarity Score:
37.45%
Best Match:
CHEMBL487059
Prediction Result:
Active^51.81%

HRH4_HUMAN

Docking Scores:
-8.40 -8.22 -8.69
Similarity Score:
32.09%
Best Match:
CHEMBL502347
Prediction Result:
Inactive^66.02%

MC3R_HUMAN

Docking Scores:
-8.67 -8.73 -8.35
Similarity Score:
31.80%
Best Match:
CHEMBL392092
Prediction Result:
Inactive^65.81%

MC4R_HUMAN

Docking Scores:
-7.31 -8.08 -8.99
Similarity Score:
33.20%
Best Match:
CHEMBL232973
Prediction Result:
Active^57.49%

MC5R_HUMAN

Docking Scores:
-6.08 -7.84 -5.32
Similarity Score:
31.16%
Best Match:
CHEMBL441738
Prediction Result:
Inactive^85.56%

MSHR_HUMAN

Docking Scores:
-7.74 -7.41 -8.21
Similarity Score:
31.62%
Best Match:
CHEMBL419307
Prediction Result:
Inactive^70.15%

NK1R_HUMAN

Docking Scores:
-9.25 -9.30 -9.03
Similarity Score:
34.27%
Best Match:
CHEMBL21788
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-9.59 -9.84 -9.27
Similarity Score:
32.26%
Best Match:
CHEMBL296419
Prediction Result:
Inactive^79.09%

NPBW1_HUMAN

Docking Scores:
-8.89 -9.46 -9.27
Similarity Score:
31.87%
Best Match:
CHEMBL1991452
Prediction Result:
Inactive^74.90%

NPFF1_HUMAN

Docking Scores:
-9.29 -8.95 -9.40
Similarity Score:
28.26%
Best Match:
CHEMBL3422516
Prediction Result:
Inactive^78.05%

NPSR1_HUMAN

Docking Scores:
-9.17 -8.91 -9.64
Similarity Score:
35.55%
Best Match:
CHEMBL1801358
Prediction Result:
Inactive^52.75%

NPY1R_HUMAN

Docking Scores:
-11.97 -10.20 -10.21
Similarity Score:
33.99%
Best Match:
CHEMBL145663
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-8.95 -9.24 -8.74
Similarity Score:
31.88%
Best Match:
CHEMBL4283257
Prediction Result:
Inactive^80.18%

NPY4R_HUMAN

Docking Scores:
-10.44 -9.59 -9.27
Similarity Score:
31.54%
Best Match:
CHEMBL4279794
Prediction Result:
Inactive^98.89%

NPY5R_HUMAN

Docking Scores:
-9.14 -9.00 -8.95
Similarity Score:
33.58%
Best Match:
CHEMBL492567
Prediction Result:
Inactive^56.58%

OPRD_HUMAN

Docking Scores:
-9.06 -7.43 -8.09
Similarity Score:
36.28%
Best Match:
CHEMBL4649042
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-10.58 -9.48 -8.21
Similarity Score:
36.28%
Best Match:
CHEMBL4649042
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-9.09 -8.22 -8.42
Similarity Score:
36.28%
Best Match:
CHEMBL4649042
Prediction Result:
Inactive^70.12%