Y-1 #10 Output Download CSV

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

Docking Scores:
-7.19 -6.88 -7.21
Similarity Score:
30.41%
Best Match:
CHEMBL3656920
Prediction Result:
Inactive82.06%

5HT1B_HUMAN

Docking Scores:
-6.92 -7.16 -6.78
Similarity Score:
22.44%
Best Match:
CHEMBL424128
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-7.24 -6.35 -6.00
Similarity Score:
22.44%
Best Match:
CHEMBL424128
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-6.79 -7.30 -7.02
Similarity Score:
13.87%
Best Match:
CHEMBL29410
Prediction Result:
Inactive55.12%

5HT1F_HUMAN

Docking Scores:
-6.55 -6.84 -7.15
Similarity Score:
15.62%
Best Match:
CHEMBL184994
Prediction Result:
Inactive82.65%

5HT2A_HUMAN

Docking Scores:
-7.20 -6.85
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-6.96 -6.90 -6.91
Similarity Score:
37.17%
Best Match:
CHEMBL1629810
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-6.89 -7.08
Similarity Score:
37.17%
Best Match:
CHEMBL1629810
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-7.12 -7.36 -6.80
Similarity Score:
27.13%
Best Match:
CHEMBL2152922
Prediction Result:
Inactive69.46%

5HT5A_HUMAN

Docking Scores:
-7.26 -6.02 -6.75
Similarity Score:
19.07%
Best Match:
CHEMBL538029
Prediction Result:
Inactive68.24%

5HT6R_HUMAN

Docking Scores:
-7.51 -6.49 -6.89
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
Inactive55.62%

5HT7R_HUMAN

Docking Scores:
-6.86 -6.92 -7.41
Similarity Score:
21.82%
Best Match:
CHEMBL2401935
Prediction Result:
Inactive67.72%

AA1R_HUMAN

Docking Scores:
-6.95 -6.52 -6.46
Similarity Score:
26.92%
Best Match:
CHEMBL1990267
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-6.08 -6.03 -6.89
Similarity Score:
29.61%
Best Match:
CHEMBL2042062
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-6.59 -7.57 -6.66
Similarity Score:
26.92%
Best Match:
CHEMBL1990267
Prediction Result:
Inactive54.50%

AA3R_HUMAN

Docking Scores:
-6.71 -6.09 -6.62
Similarity Score:
32.20%
Best Match:
CHEMBL76273
Prediction Result:
Inactive56.84%

ACM1_HUMAN

Docking Scores:
-7.85 -6.28
Similarity Score:
25.00%
Best Match:
CHEMBL435353
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-6.80 -7.02 -7.13
Similarity Score:
25.00%
Best Match:
CHEMBL435353
Prediction Result:
Inactive78.18%

ACM3_HUMAN

Docking Scores:
-7.01 -7.68 -7.52
Similarity Score:
25.00%
Best Match:
CHEMBL435353
Prediction Result:
Inactive71.00%

ACM4_HUMAN

Docking Scores:
-7.65 -6.47
Similarity Score:
24.61%
Best Match:
CHEMBL1223862
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-7.34 -7.20 -7.84
Similarity Score:
24.61%
Best Match:
CHEMBL1223862
Prediction Result:
Active60.07%

ACTHR_HUMAN

Docking Scores:
-7.43 -7.19 -6.63
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-6.84 -6.69 -6.69
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
Inactive50.87%

ADA2A_HUMAN

Docking Scores:
-5.27 -7.80 -4.87
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
Active52.20%

ADA2B_HUMAN

Docking Scores:
-7.63 -7.86 -6.63
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
Active61.77%

ADA2C_HUMAN

Docking Scores:
-2.53 -2.57 -2.57
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-7.11 -6.84 -7.43
Similarity Score:
25.15%
Best Match:
CHEMBL2348211
Prediction Result:
Inactive54.69%

ADRB2_HUMAN

Docking Scores:
-6.67 -7.35 -7.01
Similarity Score:
27.86%
Best Match:
CHEMBL513104
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-7.29 -7.69 -7.22
Similarity Score:
23.04%
Best Match:
CHEMBL306233
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-6.26 -6.22 -5.68
Similarity Score:
18.18%
Best Match:
CHEMBL215160
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-7.21 -7.79 -7.29
Similarity Score:
18.62%
Best Match:
CHEMBL208859
Prediction Result:
Inactive93.10%

CALCR_HUMAN

Docking Scores:
-6.04 -6.06 -5.91
Similarity Score:
14.18%
Best Match:
CHEMBL2369886
Prediction Result:
Inactive82.69%

CCKAR_HUMAN

Docking Scores:
-6.39 -6.48 -7.07
Similarity Score:
16.14%
Best Match:
CHEMBL1774037
Prediction Result:
Inactive93.66%

CCR1_HUMAN

Docking Scores:
-6.66 -6.43 -5.97
Similarity Score:
22.92%
Best Match:
CHEMBL3099955
Prediction Result:
Inactive98.90%

CCR2_HUMAN

Docking Scores:
-6.00 -5.87 -5.61
Similarity Score:
23.44%
Best Match:
CHEMBL3263272
Prediction Result:
Inactive97.50%

CCR4_HUMAN

Docking Scores:
-7.14 -6.66 -7.06
Similarity Score:
27.87%
Best Match:
CHEMBL605581
Prediction Result:
Inactive79.87%

CCR5_HUMAN

Docking Scores:
-5.90 -6.15 -6.39
Similarity Score:
21.96%
Best Match:
CHEMBL1078712
Prediction Result:
Inactive99.65%

CLTR1_HUMAN

Docking Scores:
-7.03 -7.03 -7.26
Similarity Score:
26.18%
Best Match:
CHEMBL1213920
Prediction Result:
Inactive94.84%

CNR1_HUMAN

Docking Scores:
-6.26 -7.18 -6.79
Similarity Score:
30.60%
Best Match:
CHEMBL1923765
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-7.00 -6.97
Similarity Score:
33.85%
Best Match:
CHEMBL3410729
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-6.79
Similarity Score:
15.81%
Best Match:
CHEMBL490688
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-6.77 -6.33 -6.11
Similarity Score:
19.55%
Best Match:
CHEMBL3645131
Prediction Result:
Inactive69.90%

CXCR3_HUMAN

Docking Scores:
-6.68 -6.39 -6.22
Similarity Score:
22.28%
Best Match:
CHEMBL3956593
Prediction Result:
Inactive99.25%

CXCR4_HUMAN

Docking Scores:
-7.04 -6.29 -6.31
Similarity Score:
21.54%
Best Match:
CHEMBL1221944
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-7.38 -6.78 -7.32
Similarity Score:
20.55%
Best Match:
CHEMBL3800636
Prediction Result:
Inactive86.87%

DRD2_HUMAN

Docking Scores:
-7.00
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-6.76
Similarity Score:
35.48%
Best Match:
CHEMBL1909065
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-7.46 -7.47
Similarity Score:
27.08%
Best Match:
CHEMBL4073330
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-6.94 -7.39 -7.10
Similarity Score:
18.40%
Best Match:
CHEMBL1258223
Prediction Result:
Inactive91.61%

EDNRA_HUMAN

Docking Scores:
-6.30 -7.01 -6.74
Similarity Score:
25.43%
Best Match:
CHEMBL431651
Prediction Result:
Inactive75.32%

GABR1_HUMAN

Docking Scores:
-4.53 -5.35 -5.18
Similarity Score:
9.47%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive91.86%

GASR_HUMAN

Docking Scores:
-7.08 -6.73 -6.36
Similarity Score:
21.56%
Best Match:
CHEMBL452991
Prediction Result:
Inactive92.59%

GRM1_HUMAN

Docking Scores:
-7.56 -7.33 -7.82
Similarity Score:
19.13%
Best Match:
CHEMBL177519
Prediction Result:
Inactive78.10%

GRM2_HUMAN

Docking Scores:
-5.47 -6.14 -5.40
Similarity Score:
25.14%
Best Match:
CHEMBL485176
Prediction Result:
Inactive76.04%

GRM3_HUMAN

Docking Scores:
-7.46 -8.06 -7.58
Similarity Score:
23.18%
Best Match:
CHEMBL3955458
Prediction Result:
Inactive73.65%

GRM4_HUMAN

Docking Scores:
-3.79 -3.30 -3.44
Similarity Score:
21.85%
Best Match:
CHEMBL4105462
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-7.41 -7.46 -7.29
Similarity Score:
20.40%
Best Match:
CHEMBL426467
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-7.12 -6.85 -7.15
Similarity Score:
21.17%
Best Match:
CHEMBL275079
Prediction Result:
Inactive97.55%

GRM7_HUMAN

Docking Scores:
-6.87 -5.65 -6.15
Similarity Score:
18.06%
Best Match:
CHEMBL3560393
Prediction Result:
Inactive99.94%

GRM8_HUMAN

Docking Scores:
-5.16 -4.29 -3.28
Similarity Score:
18.06%
Best Match:
CHEMBL3560393
Prediction Result:
Inactive99.99%

HRH1_HUMAN

Docking Scores:
-7.13
Similarity Score:
22.44%
Best Match:
CHEMBL2208424
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-7.37 -6.58 -6.92
Similarity Score:
20.42%
Best Match:
CHEMBL107293
Prediction Result:
Active65.91%

HRH3_HUMAN

Docking Scores:
-6.76 -7.25 -7.36
Similarity Score:
26.22%
Best Match:
CHEMBL1935421
Prediction Result:
Inactive68.85%

HRH4_HUMAN

Docking Scores:
-7.40 -7.15 -7.17
Similarity Score:
19.37%
Best Match:
CHEMBL1934062
Prediction Result:
Inactive50.90%

MC3R_HUMAN

Docking Scores:
-6.07 -6.03 -6.36
Similarity Score:
16.83%
Best Match:
CHEMBL192450
Prediction Result:
Inactive83.65%

MC4R_HUMAN

Docking Scores:
-5.67 -5.49 -5.73
Similarity Score:
19.64%
Best Match:
CHEMBL1380969
Prediction Result:
Inactive92.47%

MC5R_HUMAN

Docking Scores:
-5.99 -6.52 -5.69
Similarity Score:
17.06%
Best Match:
CHEMBL3938186
Prediction Result:
Inactive75.21%

MSHR_HUMAN

Docking Scores:
-6.12 -6.26 -6.78
Similarity Score:
17.04%
Best Match:
CHEMBL1682208
Prediction Result:
Inactive71.45%

NK1R_HUMAN

Docking Scores:
-6.62 -6.86 -6.70
Similarity Score:
28.42%
Best Match:
CHEMBL420221
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-6.28 -6.17 -6.26
Similarity Score:
25.93%
Best Match:
CHEMBL223994
Prediction Result:
Inactive99.32%

NPBW1_HUMAN

Docking Scores:
-6.51 -6.25 -6.90
Similarity Score:
20.57%
Best Match:
CHEMBL2314298
Prediction Result:
Inactive95.57%

NPFF1_HUMAN

Docking Scores:
-6.15 -6.51 -6.14
Similarity Score:
13.68%
Best Match:
CHEMBL3361420
Prediction Result:
Inactive71.25%

NPSR1_HUMAN

Docking Scores:
-6.24 -7.08 -7.47
Similarity Score:
17.54%
Best Match:
CHEMBL3085788
Prediction Result:
Inactive83.74%

NPY1R_HUMAN

Docking Scores:
-7.05 -7.77 -6.89
Similarity Score:
29.51%
Best Match:
CHEMBL3559801
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-6.35 -6.39 -6.25
Similarity Score:
29.51%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive70.92%

NPY4R_HUMAN

Docking Scores:
-7.13 -7.09 -6.79
Similarity Score:
29.51%
Best Match:
CHEMBL3559801
Prediction Result:
Active89.10%

NPY5R_HUMAN

Docking Scores:
-6.71 -6.68 -6.78
Similarity Score:
29.51%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive82.09%

OPRD_HUMAN

Docking Scores:
-5.88 -5.25 -5.49
Similarity Score:
29.74%
Best Match:
CHEMBL3597150
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-6.58 -6.65 -6.75
Similarity Score:
33.08%
Best Match:
CHEMBL560302
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-6.46 -6.27 -6.84
Similarity Score:
30.00%
Best Match:
CHEMBL4113162
Prediction Result:
Inactive93.08%

OPRX_HUMAN

Docking Scores:
-6.37 -6.37 -5.96
Similarity Score:
25.46%
Best Match:
CHEMBL3581762
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-6.18 -5.94 -6.23
Similarity Score:
31.16%
Best Match:
CHEMBL514432
Prediction Result:
Inactive77.44%

TAAR1_HUMAN

Docking Scores:
-6.96 -7.22 -6.99
Similarity Score:
24.48%
Best Match:
CHEMBL3652684
Prediction Result:
Active68.82%

TSHR_HUMAN

Docking Scores:
-6.89 -6.86 -6.41
Similarity Score:
17.50%
Best Match:
CHEMBL1370580
Prediction Result:
Inactive93.04%

V1AR_HUMAN

Docking Scores:
-6.21 -6.42 -7.64
Similarity Score:
20.42%
Best Match:
CHEMBL1085301
Prediction Result:
Inactive98.86%

VIPR1_HUMAN

Docking Scores:
-6.53 -6.06 -6.39
Similarity Score:
12.65%
Best Match:
CHEMBL219499
Prediction Result:
N/A