123 #38 Output Download CSV

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

Docking Scores:
-4.14 -3.97 -4.17
Similarity Score:
18.18%
Best Match:
CHEMBL277120
Prediction Result:
Inactive99.99%

5HT1B_HUMAN

Docking Scores:
-4.51 -4.74 -4.57
Similarity Score:
21.43%
Best Match:
CHEMBL337539
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-4.19 -4.02 -5.10
Similarity Score:
18.18%
Best Match:
CHEMBL277120
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-4.56 -4.49 -4.46
Similarity Score:
9.52%
Best Match:
CHEMBL39
Prediction Result:
Active54.94%

5HT1F_HUMAN

Docking Scores:
-4.27 -4.27 -4.40
Similarity Score:
9.52%
Best Match:
CHEMBL39
Prediction Result:
Inactive84.38%

5HT2A_HUMAN

Docking Scores:
-4.77 -4.30
Similarity Score:
21.43%
Best Match:
CHEMBL471839
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-4.40 -4.15 -4.41
Similarity Score:
26.09%
Best Match:
CHEMBL1333512
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-4.27 -4.88
Similarity Score:
21.43%
Best Match:
CHEMBL471839
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-4.71 -4.62 -4.74
Similarity Score:
10.17%
Best Match:
CHEMBL371300
Prediction Result:
Inactive92.61%

5HT5A_HUMAN

Docking Scores:
-4.29 -4.27 -4.23
Similarity Score:
18.18%
Best Match:
CHEMBL277120
Prediction Result:
Inactive99.99%

5HT6R_HUMAN

Docking Scores:
-4.36 -4.48 -4.42
Similarity Score:
18.18%
Best Match:
CHEMBL277120
Prediction Result:
Inactive94.56%

5HT7R_HUMAN

Docking Scores:
-4.03 -4.41 -4.11
Similarity Score:
18.18%
Best Match:
CHEMBL277120
Prediction Result:
Inactive99.99%

AA1R_HUMAN

Docking Scores:
-4.24 -4.33 -4.59
Similarity Score:
11.54%
Best Match:
CHEMBL198461
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-4.42 -4.37 -4.19
Similarity Score:
12.50%
Best Match:
CHEMBL603095
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-4.04 -4.61 -3.99
Similarity Score:
10.34%
Best Match:
CHEMBL1487093
Prediction Result:
Inactive99.99%

AA3R_HUMAN

Docking Scores:
-4.82 -4.63 -4.10
Similarity Score:
12.77%
Best Match:
CHEMBL86754
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-4.84 -5.51
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-4.43 -4.03 -4.53
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
Inactive99.99%

ACM3_HUMAN

Docking Scores:
-4.03 -4.52 -4.97
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
Inactive99.99%

ACM4_HUMAN

Docking Scores:
-4.74 -4.60
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-4.28 -4.44 -4.45
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
Inactive79.86%

ACTHR_HUMAN

Docking Scores:
-6.16 -5.68 -4.82
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-4.09 -4.45 -4.17
Similarity Score:
14.29%
Best Match:
CHEMBL648
Prediction Result:
Inactive99.99%

ADA2A_HUMAN

Docking Scores:
-4.65 -4.58 -4.58
Similarity Score:
17.14%
Best Match:
CHEMBL3289522
Prediction Result:
Inactive76.29%

ADA2B_HUMAN

Docking Scores:
-4.80 -4.59 -4.80
Similarity Score:
15.00%
Best Match:
CHEMBL972
Prediction Result:
Active62.57%

ADA2C_HUMAN

Docking Scores:
-4.94 -4.75 -4.68
Similarity Score:
16.67%
Best Match:
CHEMBL1879790
Prediction Result:
Inactive62.72%

ADRB1_HUMAN

Docking Scores:
-4.25 -4.23 -4.32
Similarity Score:
13.64%
Best Match:
CHEMBL2335160
Prediction Result:
Inactive99.99%

ADRB2_HUMAN

Docking Scores:
-4.56 -4.55 -4.60
Similarity Score:
12.77%
Best Match:
CHEMBL275742
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-4.32 -4.67 -4.32
Similarity Score:
13.64%
Best Match:
CHEMBL1437
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-5.00 -5.24 -5.05
Similarity Score:
6.52%
Best Match:
CHEMBL290829
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-4.39 -4.75 -4.86
Similarity Score:
10.34%
Best Match:
CHEMBL121565
Prediction Result:
Inactive93.89%

CALCR_HUMAN

Docking Scores:
-4.19 -4.13 -4.14
Similarity Score:
4.26%
Best Match:
CHEMBL2369895
Prediction Result:
Inactive99.99%

CCKAR_HUMAN

Docking Scores:
-4.21 -4.72 -5.14
Similarity Score:
6.52%
Best Match:
CHEMBL317181
Prediction Result:
Inactive99.99%

CCR1_HUMAN

Docking Scores:
-4.62 -4.88 -3.83
Similarity Score:
9.68%
Best Match:
CHEMBL33761
Prediction Result:
Inactive99.99%

CCR2_HUMAN

Docking Scores:
-4.45 -4.10 -4.12
Similarity Score:
13.64%
Best Match:
CHEMBL18442
Prediction Result:
Inactive99.99%

CCR4_HUMAN

Docking Scores:
-3.75 -3.96 -4.57
Similarity Score:
8.57%
Best Match:
CHEMBL1618631
Prediction Result:
Inactive99.99%

CCR5_HUMAN

Docking Scores:
-4.65 -5.12 -4.77
Similarity Score:
11.54%
Best Match:
CHEMBL441635
Prediction Result:
Inactive99.75%

CLTR1_HUMAN

Docking Scores:
-4.95 -5.08 -4.85
Similarity Score:
7.41%
Best Match:
CHEMBL127842
Prediction Result:
Inactive98.24%

CNR1_HUMAN

Docking Scores:
-4.46 -4.59 -5.16
Similarity Score:
13.04%
Best Match:
CHEMBL3809355
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-4.98 -4.94
Similarity Score:
16.22%
Best Match:
CHEMBL264412
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-4.28
Similarity Score:
10.34%
Best Match:
CHEMBL184637
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-4.98 -3.67 -3.60
Similarity Score:
10.34%
Best Match:
CHEMBL191413
Prediction Result:
Inactive99.99%

CXCR3_HUMAN

Docking Scores:
-4.81 -4.79 -4.78
Similarity Score:
12.00%
Best Match:
CHEMBL2205723
Prediction Result:
Inactive99.25%

CXCR4_HUMAN

Docking Scores:
-4.76 -3.89 -4.47
Similarity Score:
13.64%
Best Match:
CHEMBL18442
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-4.26 -3.87 -4.24
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
Inactive99.99%

DRD2_HUMAN

Docking Scores:
-4.96
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-4.12
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-4.43 -4.45
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-4.60 -4.58 -4.61
Similarity Score:
13.33%
Best Match:
CHEMBL201525
Prediction Result:
Inactive80.65%

EDNRA_HUMAN

Docking Scores:
-4.68 -4.70 -4.76
Similarity Score:
9.38%
Best Match:
CHEMBL290026
Prediction Result:
Inactive95.54%

GABR1_HUMAN

Docking Scores:
-4.52 -4.64 -5.81
Similarity Score:
5.94%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive84.83%

GASR_HUMAN

Docking Scores:
-4.33 -4.43 -3.14
Similarity Score:
7.50%
Best Match:
CHEMBL38874
Prediction Result:
Inactive99.99%

GRM1_HUMAN

Docking Scores:
-4.56 -4.80 -4.73
Similarity Score:
8.82%
Best Match:
CHEMBL254372
Prediction Result:
Inactive97.68%

GRM2_HUMAN

Docking Scores:
-5.08 -5.43 -5.09
Similarity Score:
10.91%
Best Match:
CHEMBL2112585
Prediction Result:
Inactive84.12%

GRM3_HUMAN

Docking Scores:
-5.18 -5.38 -5.04
Similarity Score:
10.91%
Best Match:
CHEMBL2112584
Prediction Result:
Active56.86%

GRM4_HUMAN

Docking Scores:
-4.32 -4.12 -4.36
Similarity Score:
8.96%
Best Match:
CHEMBL578358
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-4.79 -5.56 -5.54
Similarity Score:
15.00%
Best Match:
CHEMBL371811
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-4.88 -4.86 -4.88
Similarity Score:
5.41%
Best Match:
CHEMBL566136
Prediction Result:
Inactive95.32%

GRM7_HUMAN

Docking Scores:
-4.18 -4.31 -4.72
Similarity Score:
6.90%
Best Match:
CHEMBL432038
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
-4.10 -4.43 -4.18
Similarity Score:
9.38%
Best Match:
CHEMBL277475
Prediction Result:
Inactive99.99%

HRH1_HUMAN

Docking Scores:
-5.35
Similarity Score:
16.67%
Best Match:
CHEMBL47482
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-5.10 -4.46 -5.04
Similarity Score:
11.32%
Best Match:
CHEMBL21731
Prediction Result:
Active82.76%

HRH3_HUMAN

Docking Scores:
-4.70 -4.31 -3.99
Similarity Score:
18.75%
Best Match:
CHEMBL209478
Prediction Result:
Inactive99.99%

HRH4_HUMAN

Docking Scores:
-4.30 -3.91 -3.91
Similarity Score:
12.24%
Best Match:
CHEMBL1934049
Prediction Result:
Inactive99.99%

MC3R_HUMAN

Docking Scores:
-5.06 -4.55 -4.59
Similarity Score:
7.89%
Best Match:
CHEMBL460349
Prediction Result:
Inactive73.40%

MC4R_HUMAN

Docking Scores:
-3.51 -3.44 -4.35
Similarity Score:
15.79%
Best Match:
CHEMBL195009
Prediction Result:
Inactive99.99%

MC5R_HUMAN

Docking Scores:
-3.54 -5.04 -4.07
Similarity Score:
8.00%
Best Match:
CHEMBL3962265
Prediction Result:
Inactive99.99%

MSHR_HUMAN

Docking Scores:
-4.33 -4.16 -4.92
Similarity Score:
8.82%
Best Match:
CHEMBL267020
Prediction Result:
Inactive99.99%

NK1R_HUMAN

Docking Scores:
-4.50 -4.65 -3.91
Similarity Score:
11.54%
Best Match:
CHEMBL71498
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-4.26 -4.43 -4.26
Similarity Score:
11.11%
Best Match:
CHEMBL1289
Prediction Result:
Inactive99.65%

NPBW1_HUMAN

Docking Scores:
-4.57 -3.90 -3.78
Similarity Score:
4.92%
Best Match:
CHEMBL2000406
Prediction Result:
Inactive99.99%

NPFF1_HUMAN

Docking Scores:
-4.18 -3.99 -3.91
Similarity Score:
11.76%
Best Match:
CHEMBL573297
Prediction Result:
Inactive99.99%

NPSR1_HUMAN

Docking Scores:
-4.48 -4.74 -4.54
Similarity Score:
6.98%
Best Match:
CHEMBL3086828
Prediction Result:
Inactive85.71%

NPY1R_HUMAN

Docking Scores:
-4.68 -4.86 -4.14
Similarity Score:
11.76%
Best Match:
CHEMBL3559801
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-4.37 -3.88 -4.05
Similarity Score:
11.76%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive99.99%

NPY4R_HUMAN

Docking Scores:
-4.70 -3.99 -3.64
Similarity Score:
11.76%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive99.99%

NPY5R_HUMAN

Docking Scores:
-4.00 -4.54 -4.03
Similarity Score:
11.76%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive99.99%

OPRD_HUMAN

Docking Scores:
-4.61 -3.75 -3.56
Similarity Score:
13.33%
Best Match:
CHEMBL127346
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-4.49 -4.44 -4.91
Similarity Score:
15.38%
Best Match:
CHEMBL1188090
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-4.69 -3.80 -4.30
Similarity Score:
15.38%
Best Match:
CHEMBL1188090
Prediction Result:
Inactive99.99%

OPRX_HUMAN

Docking Scores:
-4.11 -3.91 -4.02
Similarity Score:
12.50%
Best Match:
CHEMBL53256
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-4.66 -4.62 -4.99
Similarity Score:
8.00%
Best Match:
CHEMBL297624
Prediction Result:
Inactive94.57%

TAAR1_HUMAN

Docking Scores:
-4.33 -4.46 -4.20
Similarity Score:
26.09%
Best Match:
CHEMBL508991
Prediction Result:
Inactive99.99%

TSHR_HUMAN

Docking Scores:
-4.82 -4.48 -5.12
Similarity Score:
6.19%
Best Match:
CHEMBL3908443
Prediction Result:
Inactive92.61%

V1AR_HUMAN

Docking Scores:
-4.65 -5.71 -4.38
Similarity Score:
8.70%
Best Match:
CHEMBL1083095
Prediction Result:
Inactive92.25%

VIPR1_HUMAN

Docking Scores:
-4.70 -4.19 -4.48
Similarity Score:
4.41%
Best Match:
CHEMBL1784685
Prediction Result:
N/A