sa #109 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
5HT1A_HUMAN

Docking Scores:
-8.97 -7.38 -8.62
Similarity Score:
36.89%
Best Match:
CHEMBL478617
Prediction Result:
Inactive73.72%

5HT1B_HUMAN

Docking Scores:
-8.51 -9.19 -8.91
Similarity Score:
28.45%
Best Match:
CHEMBL2205816
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-7.62 -7.80 -8.83
Similarity Score:
28.07%
Best Match:
CHEMBL191460
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-8.84 -9.05 -7.26
Similarity Score:
17.90%
Best Match:
CHEMBL22744
Prediction Result:
Inactive65.86%

5HT1F_HUMAN

Docking Scores:
-9.44 -9.58 -9.47
Similarity Score:
20.51%
Best Match:
CHEMBL418806
Prediction Result:
Inactive81.02%

5HT2A_HUMAN

Docking Scores:
-8.81 -7.12
Similarity Score:
42.06%
Best Match:
CHEMBL1276947
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-9.50 -10.23 -8.94
Similarity Score:
42.06%
Best Match:
CHEMBL1276947
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.95 -9.86
Similarity Score:
42.06%
Best Match:
CHEMBL1276947
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-7.93 -8.68 -7.76
Similarity Score:
27.48%
Best Match:
CHEMBL555447
Prediction Result:
Inactive78.54%

5HT5A_HUMAN

Docking Scores:
-9.31 -8.37 -8.81
Similarity Score:
29.31%
Best Match:
CHEMBL185676
Prediction Result:
Inactive69.53%

5HT6R_HUMAN

Docking Scores:
-8.30 -8.54 -8.57
Similarity Score:
28.99%
Best Match:
CHEMBL98511
Prediction Result:
Active55.38%

5HT7R_HUMAN

Docking Scores:
-8.81 -9.15 -6.67
Similarity Score:
46.84%
Best Match:
CHEMBL485803
Prediction Result:
Active53.16%

AA1R_HUMAN

Docking Scores:
-8.59 -9.72 -8.06
Similarity Score:
29.08%
Best Match:
CHEMBL2112177
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-5.91 -6.98 -8.85
Similarity Score:
24.70%
Best Match:
CHEMBL2070508
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-9.91 -9.46 -9.31
Similarity Score:
25.62%
Best Match:
CHEMBL384257
Prediction Result:
Inactive70.33%

AA3R_HUMAN

Docking Scores:
-2.63 -0.98 -8.90
Similarity Score:
57.69%
Best Match:
CHEMBL275040
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-10.99 10.46
Similarity Score:
46.75%
Best Match:
CHEMBL172969
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-8.62 -8.39 -11.20
Similarity Score:
60.27%
Best Match:
CHEMBL64788
Prediction Result:
Active79.29%

ACM3_HUMAN

Docking Scores:
-10.32 -8.46 -8.48
Similarity Score:
44.71%
Best Match:
CHEMBL480464
Prediction Result:
Active69.04%

ACM4_HUMAN

Docking Scores:
-10.01 -8.09
Similarity Score:
44.71%
Best Match:
CHEMBL480464
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-10.69 -10.59 -6.83
Similarity Score:
43.30%
Best Match:
CHEMBL277642
Prediction Result:
Active78.02%

ACTHR_HUMAN

Docking Scores:
-9.70 -9.90 -10.13
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-10.00 -8.54 -9.77
Similarity Score:
34.31%
Best Match:
CHEMBL517712
Prediction Result:
Active59.80%

ADA2A_HUMAN

Docking Scores:
-0.25 1.71 3.62
Similarity Score:
40.00%
Best Match:
CHEMBL191703
Prediction Result:
Inactive99.99%

ADA2B_HUMAN

Docking Scores:
-8.07 -4.47 -4.24
Similarity Score:
34.82%
Best Match:
CHEMBL210578
Prediction Result:
Inactive99.99%

ADA2C_HUMAN

Docking Scores:
2.89 4.19 3.89
Similarity Score:
40.00%
Best Match:
CHEMBL191703
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-9.16 -6.96 -8.93
Similarity Score:
30.25%
Best Match:
CHEMBL1085009
Prediction Result:
Inactive75.96%

ADRB2_HUMAN

Docking Scores:
-7.86 -8.34 -10.68
Similarity Score:
33.33%
Best Match:
CHEMBL1459608
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-9.71 -7.68 -9.29
Similarity Score:
33.60%
Best Match:
CHEMBL3746280
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.70 -9.28 -8.88
Similarity Score:
26.09%
Best Match:
CHEMBL3350599
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-8.17 -8.72 -8.72
Similarity Score:
32.98%
Best Match:
CHEMBL109172
Prediction Result:
Inactive77.42%

CALCR_HUMAN

Docking Scores:
-8.62 -8.28 -8.55
Similarity Score:
29.30%
Best Match:
CHEMBL2369895
Prediction Result:
Inactive98.28%

CCKAR_HUMAN

Docking Scores:
-8.39 -8.07 -9.19
Similarity Score:
35.00%
Best Match:
CHEMBL206025
Prediction Result:
Inactive89.51%

CCR1_HUMAN

Docking Scores:
-9.85 -8.59 -7.54
Similarity Score:
40.74%
Best Match:
CHEMBL3679652
Prediction Result:
Inactive78.82%

CCR2_HUMAN

Docking Scores:
-8.58 -10.13 -8.62
Similarity Score:
42.59%
Best Match:
CHEMBL523054
Prediction Result:
Active55.23%

CCR4_HUMAN

Docking Scores:
-6.52 -6.90 -7.13
Similarity Score:
30.97%
Best Match:
CHEMBL1621896
Prediction Result:
Inactive82.56%

CCR5_HUMAN

Docking Scores:
-8.57 -8.21 -9.46
Similarity Score:
35.51%
Best Match:
CHEMBL322603
Prediction Result:
Inactive88.15%

CLTR1_HUMAN

Docking Scores:
-8.75 -9.27 -9.24
Similarity Score:
24.12%
Best Match:
CHEMBL3342957
Prediction Result:
Inactive87.23%

CNR1_HUMAN

Docking Scores:
-8.34 -9.09 -7.75
Similarity Score:
51.28%
Best Match:
CHEMBL472661
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-8.52 -10.26
Similarity Score:
51.28%
Best Match:
CHEMBL472661
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-3.50
Similarity Score:
22.34%
Best Match:
CHEMBL556862
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-7.99 -8.11 -8.05
Similarity Score:
28.03%
Best Match:
CHEMBL3645131
Prediction Result:
Inactive65.74%

CXCR3_HUMAN

Docking Scores:
-9.45 -9.24 -9.13
Similarity Score:
33.90%
Best Match:
CHEMBL3697091
Prediction Result:
Inactive77.88%

CXCR4_HUMAN

Docking Scores:
-9.25 -7.45 -8.82
Similarity Score:
28.03%
Best Match:
CHEMBL366033
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-8.76 -10.74 -9.90
Similarity Score:
37.62%
Best Match:
CHEMBL1779058
Prediction Result:
Active60.44%

DRD2_HUMAN

Docking Scores:
-7.94
Similarity Score:
36.89%
Best Match:
CHEMBL478617
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-9.77
Similarity Score:
34.82%
Best Match:
CHEMBL210578
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-9.75 -9.96
Similarity Score:
37.62%
Best Match:
CHEMBL1779058
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-8.38 -9.55 -7.47
Similarity Score:
28.83%
Best Match:
CHEMBL54
Prediction Result:
Inactive78.12%

EDNRA_HUMAN

Docking Scores:
-8.22 -8.34 -8.52
Similarity Score:
34.19%
Best Match:
CHEMBL315927
Prediction Result:
Inactive58.70%

GABR1_HUMAN

Docking Scores:
9.14 6.56 28.60
Similarity Score:
17.27%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive99.99%

GASR_HUMAN

Docking Scores:
-8.13 -8.41 -7.51
Similarity Score:
39.67%
Best Match:
CHEMBL289008
Prediction Result:
Inactive68.57%

GRM1_HUMAN

Docking Scores:
-9.05 -5.98 -3.49
Similarity Score:
38.57%
Best Match:
CHEMBL38499
Prediction Result:
Inactive99.99%

GRM2_HUMAN

Docking Scores:
-0.43 3.84 0.23
Similarity Score:
56.34%
Best Match:
CHEMBL2381641
Prediction Result:
Inactive99.99%

GRM3_HUMAN

Docking Scores:
-0.45 -0.48 0.52
Similarity Score:
56.34%
Best Match:
CHEMBL2381641
Prediction Result:
Inactive99.99%

GRM4_HUMAN

Docking Scores:
11.62 10.97 10.34
Similarity Score:
34.31%
Best Match:
CHEMBL578988
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-4.26 -0.62 -1.45
Similarity Score:
46.27%
Best Match:
CHEMBL90501
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-1.96 -2.47 -2.36
Similarity Score:
56.34%
Best Match:
CHEMBL2381641
Prediction Result:
Inactive99.99%

GRM7_HUMAN

Docking Scores:
1.39 4.11 3.07
Similarity Score:
25.21%
Best Match:
CHEMBL432038
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
9.87 10.93 15.18
Similarity Score:
42.42%
Best Match:
CHEMBL280563
Prediction Result:
Inactive99.99%

HRH1_HUMAN

Docking Scores:
2.49
Similarity Score:
42.06%
Best Match:
CHEMBL1276947
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-9.38 -10.35 -9.97
Similarity Score:
31.07%
Best Match:
CHEMBL2205812
Prediction Result:
Active93.87%

HRH3_HUMAN

Docking Scores:
-8.70 -9.89 -9.75
Similarity Score:
47.50%
Best Match:
CHEMBL488209
Prediction Result:
Active73.63%

HRH4_HUMAN

Docking Scores:
-8.59 -8.07 -8.28
Similarity Score:
27.88%
Best Match:
CHEMBL1934061
Prediction Result:
Inactive62.04%

MC3R_HUMAN

Docking Scores:
-8.17 -8.53 -7.23
Similarity Score:
37.89%
Best Match:
CHEMBL407135
Prediction Result:
Inactive67.02%

MC4R_HUMAN

Docking Scores:
-8.32 -8.27 -8.40
Similarity Score:
37.89%
Best Match:
CHEMBL407135
Prediction Result:
Inactive73.88%

MC5R_HUMAN

Docking Scores:
-4.07 -5.60 -4.90
Similarity Score:
37.89%
Best Match:
CHEMBL407135
Prediction Result:
Inactive99.99%

MSHR_HUMAN

Docking Scores:
-7.34 -7.41 -9.25
Similarity Score:
30.71%
Best Match:
CHEMBL2310901
Prediction Result:
Inactive52.50%

NK1R_HUMAN

Docking Scores:
-10.06 -7.79 -8.39
Similarity Score:
36.30%
Best Match:
CHEMBL202568
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-9.18 -9.53 -9.50
Similarity Score:
34.45%
Best Match:
CHEMBL4068783
Prediction Result:
Inactive79.49%

NPBW1_HUMAN

Docking Scores:
-8.55 -8.76 -10.20
Similarity Score:
21.71%
Best Match:
CHEMBL1940539
Prediction Result:
Inactive60.18%

NPFF1_HUMAN

Docking Scores:
-8.87 -9.22 -8.66
Similarity Score:
26.72%
Best Match:
CHEMBL1672379
Prediction Result:
Inactive69.12%

NPSR1_HUMAN

Docking Scores:
-9.24 -9.14 -9.43
Similarity Score:
25.32%
Best Match:
CHEMBL230333
Prediction Result:
Inactive66.13%

NPY1R_HUMAN

Docking Scores:
-9.73 -9.50 -9.94
Similarity Score:
32.77%
Best Match:
CHEMBL549377
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-8.55 -8.61 -8.37
Similarity Score:
38.89%
Best Match:
CHEMBL4089420
Prediction Result:
Inactive88.29%

NPY4R_HUMAN

Docking Scores:
-9.44 -10.64 -8.91
Similarity Score:
27.78%
Best Match:
CHEMBL2440195
Prediction Result:
Inactive98.95%

NPY5R_HUMAN

Docking Scores:
-8.93 -8.87 -8.79
Similarity Score:
27.34%
Best Match:
CHEMBL3126039
Prediction Result:
Inactive64.37%

OPRD_HUMAN

Docking Scores:
-8.29 -7.96 -8.35
Similarity Score:
38.55%
Best Match:
CHEMBL3326796
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-10.39 -8.01 -8.29
Similarity Score:
48.39%
Best Match:
CHEMBL3890935
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-9.00 -8.45 -8.00
Similarity Score:
48.39%
Best Match:
CHEMBL3958393
Prediction Result:
Inactive57.37%

OPRX_HUMAN

Docking Scores:
-8.16 -8.13 -8.56
Similarity Score:
40.35%
Best Match:
CHEMBL506634
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-8.42 -8.63 -8.34
Similarity Score:
24.81%
Best Match:
CHEMBL52693
Prediction Result:
Inactive76.74%

TAAR1_HUMAN

Docking Scores:
-8.25 -10.39 -8.44
Similarity Score:
48.00%
Best Match:
CHEMBL1724146
Prediction Result:
Inactive58.10%

TSHR_HUMAN

Docking Scores:
-10.03 -10.94 -10.23
Similarity Score:
21.18%
Best Match:
CHEMBL3897841
Prediction Result:
Inactive87.03%

V1AR_HUMAN

Docking Scores:
-7.65 -8.60 -8.45
Similarity Score:
31.09%
Best Match:
CHEMBL1807279
Prediction Result:
Inactive92.61%

VIPR1_HUMAN

Docking Scores:
-8.45 -8.92 -9.64
Similarity Score:
25.14%
Best Match:
CHEMBL3884667
Prediction Result:
N/A