JLK-fentanyl #234 Output - DAKB-GPCRS

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JLK-fentanyl #234 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

ACM5_HUMAN

Docking Scores:
-9.48 -9.28 -9.22
Similarity Score:
68.48%
Best Match:
CHEMBL3354078
Prediction Result:
Active^66.91%

ACTHR_HUMAN

Docking Scores:
-9.98 -9.97 -8.84
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-8.93 -8.52 -8.68
Similarity Score:
68.48%
Best Match:
CHEMBL4072818
Prediction Result:
Active^89.88%

ADA2A_HUMAN

Docking Scores:
-6.41 -4.75 0.53
Similarity Score:
42.16%
Best Match:
CHEMBL395110
Prediction Result:
Inactive^99.99%

ADA2B_HUMAN

Docking Scores:
-9.71 -7.28 -6.54
Similarity Score:
52.88%
Best Match:
CHEMBL279516
Prediction Result:
Active^54.38%

ADA2C_HUMAN

Docking Scores:
-1.26 -1.97 9.55
Similarity Score:
52.88%
Best Match:
CHEMBL279516
Prediction Result:
Inactive^99.99%

ADRB1_HUMAN

Docking Scores:
-9.22 -8.83 -8.48
Similarity Score:
56.88%
Best Match:
CHEMBL421030
Prediction Result:
Active^82.17%

ADRB2_HUMAN

Docking Scores:
-9.15 -9.68 -9.48
Similarity Score:
54.72%
Best Match:
CHEMBL1306990
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-9.36 -9.30 -8.69
Similarity Score:
56.88%
Best Match:
CHEMBL421030
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-9.77 -10.07 -9.94
Similarity Score:
36.50%
Best Match:
CHEMBL268815
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-9.05 -9.53 -9.43
Similarity Score:
51.02%
Best Match:
CHEMBL109123
Prediction Result:
Active^72.10%

CALCR_HUMAN

Docking Scores:
-7.84 -8.50 -8.55
Similarity Score:
32.28%
Best Match:
CHEMBL2369895
Prediction Result:
Inactive^98.16%

CCKAR_HUMAN

Docking Scores:
-8.57 -8.42 -9.05
Similarity Score:
48.00%
Best Match:
CHEMBL105619
Prediction Result:
Inactive^71.63%

CCR1_HUMAN

Docking Scores:
-8.24 -8.28 -8.56
Similarity Score:
64.56%
Best Match:
CHEMBL33761
Prediction Result:
Active^64.44%

CCR2_HUMAN

Docking Scores:
-7.65 -8.85 -8.35
Similarity Score:
55.66%
Best Match:
CHEMBL2036755
Prediction Result:
Active^71.58%

CCR4_HUMAN

Docking Scores:
-8.07 -8.45 -9.07
Similarity Score:
42.22%
Best Match:
CHEMBL395680
Prediction Result:
Inactive^60.05%

CCR5_HUMAN

Docking Scores:
-8.22 -8.85 -8.47
Similarity Score:
78.16%
Best Match:
CHEMBL3104691
Prediction Result:
Active^93.01%

CLTR1_HUMAN

Docking Scores:
-7.95 -9.96 -9.38
Similarity Score:
38.58%
Best Match:
CHEMBL129866
Prediction Result:
Inactive^74.75%

CNR1_HUMAN

Docking Scores:
-9.28 -9.58 -10.01
Similarity Score:
55.95%
Best Match:
CHEMBL479095
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-10.14 -10.44
Similarity Score:
70.11%
Best Match:
CHEMBL2338188
Prediction Result:
N/A