Acetaminophen #56 Output Download CSV

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

Docking Scores:
-6.03 -5.84 -5.96
Similarity Score:
52.83%
Best Match:
CHEMBL129661
Prediction Result:
Active72.22%

5HT1B_HUMAN

Docking Scores:
-6.67 -6.64 -5.91
Similarity Score:
52.83%
Best Match:
CHEMBL129661
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-6.23 -6.00 -6.71
Similarity Score:
52.83%
Best Match:
CHEMBL129661
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-6.56 -6.21 -6.43
Similarity Score:
25.00%
Best Match:
CHEMBL39
Prediction Result:
Inactive66.29%

5HT1F_HUMAN

Docking Scores:
-6.72 -5.71 -6.13
Similarity Score:
32.17%
Best Match:
CHEMBL184994
Prediction Result:
Inactive71.37%

5HT2A_HUMAN

Docking Scores:
-6.12 -6.18
Similarity Score:
48.94%
Best Match:
CHEMBL277120
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-6.01 -5.91 -6.02
Similarity Score:
44.62%
Best Match:
CHEMBL57135
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-6.24 -6.31
Similarity Score:
44.62%
Best Match:
CHEMBL57135
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-6.23 -6.25 -6.18
Similarity Score:
28.83%
Best Match:
CHEMBL339936
Prediction Result:
Inactive65.12%

5HT5A_HUMAN

Docking Scores:
-6.04 -6.23 -6.18
Similarity Score:
63.83%
Best Match:
CHEMBL24462
Prediction Result:
Active87.85%

5HT6R_HUMAN

Docking Scores:
-5.85 -5.65 -5.79
Similarity Score:
49.12%
Best Match:
CHEMBL9666
Prediction Result:
Inactive57.86%

5HT7R_HUMAN

Docking Scores:
-6.09 -5.98 -5.77
Similarity Score:
54.90%
Best Match:
CHEMBL3262404
Prediction Result:
Active88.96%

AA1R_HUMAN

Docking Scores:
-5.56 -5.73 -5.75
Similarity Score:
36.27%
Best Match:
CHEMBL1814055
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-5.97 -5.95 -5.88
Similarity Score:
36.27%
Best Match:
CHEMBL1814055
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-5.72 -6.33 -5.94
Similarity Score:
36.27%
Best Match:
CHEMBL1814055
Prediction Result:
Active56.42%

AA3R_HUMAN

Docking Scores:
-6.30 -6.15 -5.74
Similarity Score:
36.27%
Best Match:
CHEMBL1814055
Prediction Result:
Active54.31%

ACM1_HUMAN

Docking Scores:
-6.40 -7.19
Similarity Score:
37.63%
Best Match:
CHEMBL1092460
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-6.08 -6.00 -6.28
Similarity Score:
46.25%
Best Match:
CHEMBL83982
Prediction Result:
Active75.69%

ACM3_HUMAN

Docking Scores:
-5.70 -6.49 -6.33
Similarity Score:
46.25%
Best Match:
CHEMBL83982
Prediction Result:
Inactive52.02%

ACM4_HUMAN

Docking Scores:
-6.42 -5.80
Similarity Score:
34.09%
Best Match:
CHEMBL7568
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-6.39 -6.22 -6.28
Similarity Score:
33.33%
Best Match:
CHEMBL3354078
Prediction Result:
Inactive69.75%

ACTHR_HUMAN

Docking Scores:
-7.34 -6.61 -5.72
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-5.61 -6.22 -5.61
Similarity Score:
42.25%
Best Match:
CHEMBL114669
Prediction Result:
Active68.87%

ADA2A_HUMAN

Docking Scores:
-6.34 -6.29 -5.76
Similarity Score:
44.83%
Best Match:
CHEMBL3289540
Prediction Result:
Active67.80%

ADA2B_HUMAN

Docking Scores:
-6.48 -6.56 -6.45
Similarity Score:
34.09%
Best Match:
CHEMBL7568
Prediction Result:
Active56.40%

ADA2C_HUMAN

Docking Scores:
-5.87 -5.51 -5.07
Similarity Score:
46.00%
Best Match:
CHEMBL1879790
Prediction Result:
Active67.21%

ADRB1_HUMAN

Docking Scores:
-5.95 -6.04 -6.04
Similarity Score:
41.18%
Best Match:
CHEMBL13102
Prediction Result:
Active50.94%

ADRB2_HUMAN

Docking Scores:
-6.09 -6.39 -6.58
Similarity Score:
41.18%
Best Match:
CHEMBL13102
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-6.46 -6.74 -6.43
Similarity Score:
41.18%
Best Match:
CHEMBL13102
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-5.86 -6.03 -5.90
Similarity Score:
29.00%
Best Match:
CHEMBL290829
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-6.21 -6.75 -6.20
Similarity Score:
26.73%
Best Match:
CHEMBL110652
Prediction Result:
Inactive75.11%

CALCR_HUMAN

Docking Scores:
-5.58 -5.31 -6.08
Similarity Score:
14.84%
Best Match:
CHEMBL2369895
Prediction Result:
Active71.16%

CCKAR_HUMAN

Docking Scores:
-5.48 -5.50 -6.57
Similarity Score:
34.91%
Best Match:
CHEMBL443825
Prediction Result:
Inactive96.61%

CCR1_HUMAN

Docking Scores:
-5.77 -6.29 -5.25
Similarity Score:
32.41%
Best Match:
CHEMBL2208416
Prediction Result:
Inactive98.64%

CCR2_HUMAN

Docking Scores:
-5.21 -5.27 -5.35
Similarity Score:
35.63%
Best Match:
CHEMBL246520
Prediction Result:
Inactive91.42%

CCR4_HUMAN

Docking Scores:
-5.41 -5.78 -6.19
Similarity Score:
27.43%
Best Match:
CHEMBL600196
Prediction Result:
Inactive79.05%

CCR5_HUMAN

Docking Scores:
-5.56 -5.34 -5.33
Similarity Score:
36.99%
Best Match:
CHEMBL433635
Prediction Result:
Inactive99.51%

CLTR1_HUMAN

Docking Scores:
-6.23 -6.89 -6.63
Similarity Score:
31.82%
Best Match:
CHEMBL129866
Prediction Result:
Inactive97.40%

CNR1_HUMAN

Docking Scores:
-5.92 -6.14 -6.28
Similarity Score:
49.33%
Best Match:
CHEMBL200094
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-6.16 -6.08
Similarity Score:
41.82%
Best Match:
CHEMBL2336559
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-6.41
Similarity Score:
50.79%
Best Match:
CHEMBL184637
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-5.85 -5.40 -5.24
Similarity Score:
44.12%
Best Match:
CHEMBL25573
Prediction Result:
Inactive61.20%

CXCR3_HUMAN

Docking Scores:
-6.09 -6.11 -6.06
Similarity Score:
32.38%
Best Match:
CHEMBL245271
Prediction Result:
Inactive98.87%

CXCR4_HUMAN

Docking Scores:
-6.73 -5.63 -5.82
Similarity Score:
29.33%
Best Match:
CHEMBL2347630
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-6.12 -5.93 -5.67
Similarity Score:
35.56%
Best Match:
CHEMBL25236
Prediction Result:
Inactive63.56%

DRD2_HUMAN

Docking Scores:
-6.47
Similarity Score:
50.91%
Best Match:
CHEMBL447809
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-6.05
Similarity Score:
49.12%
Best Match:
CHEMBL2165674
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-6.38 -6.37
Similarity Score:
55.22%
Best Match:
CHEMBL184772
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-6.05 -6.17 -6.24
Similarity Score:
33.98%
Best Match:
CHEMBL394080
Prediction Result:
Inactive86.45%

EDNRA_HUMAN

Docking Scores:
-5.10 -6.79 -5.14
Similarity Score:
25.55%
Best Match:
CHEMBL10905
Prediction Result:
Inactive87.63%

GABR1_HUMAN

Docking Scores:
-6.03 -6.39 -6.68
Similarity Score:
13.68%
Best Match:
CHEMBL392394
Prediction Result:
Inactive90.79%

GASR_HUMAN

Docking Scores:
-5.96 -6.00 -5.64
Similarity Score:
34.91%
Best Match:
CHEMBL443825
Prediction Result:
Inactive91.03%

GRM1_HUMAN

Docking Scores:
-6.73 -6.42 -6.29
Similarity Score:
32.53%
Best Match:
CHEMBL254575
Prediction Result:
Inactive81.84%

GRM2_HUMAN

Docking Scores:
-6.32 -6.70 -6.60
Similarity Score:
32.95%
Best Match:
CHEMBL468800
Prediction Result:
Inactive73.86%

GRM3_HUMAN

Docking Scores:
-7.08 -7.23 -6.84
Similarity Score:
24.18%
Best Match:
CHEMBL1630807
Prediction Result:
Inactive70.58%

GRM4_HUMAN

Docking Scores:
-5.05 -5.03 -4.88
Similarity Score:
39.77%
Best Match:
CHEMBL3609733
Prediction Result:
Inactive92.11%

GRM5_HUMAN

Docking Scores:
-6.77 -6.97 -7.16
Similarity Score:
41.18%
Best Match:
CHEMBL1080481
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-6.32 -6.31 -6.33
Similarity Score:
23.23%
Best Match:
CHEMBL2418359
Prediction Result:
Inactive95.10%

GRM7_HUMAN

Docking Scores:
-6.33 -5.94 -6.71
Similarity Score:
26.24%
Best Match:
CHEMBL3560612
Prediction Result:
Inactive99.88%

GRM8_HUMAN

Docking Scores:
-5.66 -5.92 -5.88
Similarity Score:
26.24%
Best Match:
CHEMBL3560612
Prediction Result:
Inactive98.63%

HRH1_HUMAN

Docking Scores:
-6.90
Similarity Score:
40.58%
Best Match:
CHEMBL1940414
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-7.18 -6.39 -7.30
Similarity Score:
30.17%
Best Match:
CHEMBL194837
Prediction Result:
Active82.87%

HRH3_HUMAN

Docking Scores:
-5.73 -5.50 -5.81
Similarity Score:
47.89%
Best Match:
CHEMBL2387297
Prediction Result:
Active93.52%

HRH4_HUMAN

Docking Scores:
-5.86 -5.73 -5.83
Similarity Score:
30.53%
Best Match:
CHEMBL128958
Prediction Result:
Inactive50.11%

MC3R_HUMAN

Docking Scores:
-6.05 -5.47 -5.71
Similarity Score:
25.37%
Best Match:
CHEMBL377231
Prediction Result:
Inactive74.23%

MC4R_HUMAN

Docking Scores:
-4.76 -5.20 -4.81
Similarity Score:
39.71%
Best Match:
CHEMBL1728670
Prediction Result:
Inactive78.06%

MC5R_HUMAN

Docking Scores:
-5.80 -6.52 -5.43
Similarity Score:
26.05%
Best Match:
CHEMBL3896315
Prediction Result:
Inactive74.19%

MSHR_HUMAN

Docking Scores:
-6.51 -5.30 -6.63
Similarity Score:
24.18%
Best Match:
CHEMBL606399
Prediction Result:
Inactive64.53%

NK1R_HUMAN

Docking Scores:
-5.62 -6.00 -5.77
Similarity Score:
37.97%
Best Match:
CHEMBL40262
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-5.89 -5.54 -5.83
Similarity Score:
28.70%
Best Match:
CHEMBL303119
Prediction Result:
Inactive99.35%

NPBW1_HUMAN

Docking Scores:
-5.50 -5.17 -5.34
Similarity Score:
23.49%
Best Match:
CHEMBL1987717
Prediction Result:
Inactive89.63%

NPFF1_HUMAN

Docking Scores:
-5.20 -5.34 -5.64
Similarity Score:
28.07%
Best Match:
CHEMBL3361420
Prediction Result:
Inactive57.49%

NPSR1_HUMAN

Docking Scores:
-5.59 -6.11 -6.10
Similarity Score:
30.10%
Best Match:
CHEMBL1289780
Prediction Result:
Inactive84.79%

NPY1R_HUMAN

Docking Scores:
-6.57 -6.52 -5.70
Similarity Score:
30.43%
Best Match:
CHEMBL2046861
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-5.57 -5.31 -5.34
Similarity Score:
35.71%
Best Match:
CHEMBL1287954
Prediction Result:
Inactive52.31%

NPY4R_HUMAN

Docking Scores:
-6.08 -5.67 -5.46
Similarity Score:
19.09%
Best Match:
CHEMBL2440199
Prediction Result:
Active94.31%

NPY5R_HUMAN

Docking Scores:
-5.89 -6.09 -6.07
Similarity Score:
51.52%
Best Match:
CHEMBL77355
Prediction Result:
Inactive71.34%

OPRD_HUMAN

Docking Scores:
-5.63 -4.77 -5.46
Similarity Score:
43.04%
Best Match:
CHEMBL416930
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-5.65 -6.23 -6.55
Similarity Score:
41.18%
Best Match:
CHEMBL283552
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-5.81 -5.17 -5.59
Similarity Score:
46.88%
Best Match:
CHEMBL371268
Prediction Result:
Inactive79.44%

OPRX_HUMAN

Docking Scores:
-5.31 -5.57 -5.43
Similarity Score:
38.96%
Best Match:
CHEMBL3665425
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-6.15 -6.04 -5.98
Similarity Score:
31.82%
Best Match:
CHEMBL54106
Prediction Result:
Inactive77.02%

TAAR1_HUMAN

Docking Scores:
-6.25 -6.44 -5.82
Similarity Score:
40.68%
Best Match:
CHEMBL1445005
Prediction Result:
Active77.40%

TSHR_HUMAN

Docking Scores:
-5.86 -6.18 -5.97
Similarity Score:
30.19%
Best Match:
CHEMBL3911383
Prediction Result:
Inactive90.32%

V1AR_HUMAN

Docking Scores:
-6.32 -5.53 -6.57
Similarity Score:
33.71%
Best Match:
CHEMBL106229
Prediction Result:
Inactive93.74%

VIPR1_HUMAN

Docking Scores:
-5.57 -5.81 -5.52
Similarity Score:
17.69%
Best Match:
CHEMBL1784685
Prediction Result:
N/A