D9-1 #13 Output Download CSV

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

Docking Scores:
-6.99 -6.86 -7.60
Similarity Score:
29.30%
Best Match:
CHEMBL275572
Prediction Result:
Inactive81.01%

5HT1B_HUMAN

Docking Scores:
-7.56 -6.95 -7.31
Similarity Score:
28.76%
Best Match:
CHEMBL1279
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-7.33 -7.28 -6.14
Similarity Score:
28.76%
Best Match:
CHEMBL1279
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-7.26 -7.18 -6.61
Similarity Score:
25.00%
Best Match:
CHEMBL105261
Prediction Result:
Inactive56.18%

5HT1F_HUMAN

Docking Scores:
-6.88 -7.30 -7.03
Similarity Score:
28.40%
Best Match:
CHEMBL102292
Prediction Result:
Inactive68.93%

5HT2A_HUMAN

Docking Scores:
-7.10 -6.92
Similarity Score:
30.92%
Best Match:
CHEMBL559251
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-6.96 -7.19 -7.35
Similarity Score:
28.91%
Best Match:
CHEMBL474404
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-6.94 -7.18
Similarity Score:
28.24%
Best Match:
CHEMBL162901
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-7.76 -7.56 -7.15
Similarity Score:
27.38%
Best Match:
CHEMBL401607
Prediction Result:
Inactive74.12%

5HT5A_HUMAN

Docking Scores:
-7.35 -7.18 -7.23
Similarity Score:
26.52%
Best Match:
CHEMBL270840
Prediction Result:
Inactive68.51%

5HT6R_HUMAN

Docking Scores:
-6.98 -6.71 -7.36
Similarity Score:
27.81%
Best Match:
CHEMBL3423339
Prediction Result:
Inactive64.41%

5HT7R_HUMAN

Docking Scores:
-7.31 -7.28 -7.13
Similarity Score:
29.10%
Best Match:
CHEMBL3959209
Prediction Result:
Inactive75.50%

AA1R_HUMAN

Docking Scores:
-7.25 -7.00 -7.79
Similarity Score:
33.76%
Best Match:
CHEMBL364036
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-6.82 -7.51 -7.20
Similarity Score:
29.66%
Best Match:
CHEMBL3093327
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-7.53 -7.76 -6.87
Similarity Score:
31.21%
Best Match:
CHEMBL37243
Prediction Result:
Inactive59.92%

AA3R_HUMAN

Docking Scores:
-7.14 -7.34 -8.13
Similarity Score:
33.76%
Best Match:
CHEMBL364036
Prediction Result:
Active52.38%

ACM1_HUMAN

Docking Scores:
-8.08 -7.23
Similarity Score:
27.42%
Best Match:
CHEMBL1201353
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-6.91 -7.38 -7.83
Similarity Score:
27.27%
Best Match:
CHEMBL4097258
Prediction Result:
Inactive77.75%

ACM3_HUMAN

Docking Scores:
-7.00 -8.18 -8.23
Similarity Score:
28.77%
Best Match:
CHEMBL207287
Prediction Result:
Inactive73.35%

ACM4_HUMAN

Docking Scores:
-7.47 -7.78
Similarity Score:
27.42%
Best Match:
CHEMBL1201353
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-7.96 -7.55 -7.87
Similarity Score:
27.42%
Best Match:
CHEMBL1201353
Prediction Result:
Active62.73%

ACTHR_HUMAN

Docking Scores:
-7.47 -7.22 -7.42
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-6.89 -7.23 -7.21
Similarity Score:
30.53%
Best Match:
CHEMBL511411
Prediction Result:
Active55.33%

ADA2A_HUMAN

Docking Scores:
-7.57 -7.92 -7.15
Similarity Score:
39.64%
Best Match:
CHEMBL260374
Prediction Result:
Active85.34%

ADA2B_HUMAN

Docking Scores:
-7.60 -7.76 -7.22
Similarity Score:
26.67%
Best Match:
CHEMBL85
Prediction Result:
Inactive50.72%

ADA2C_HUMAN

Docking Scores:
-4.90 -4.46 -4.14
Similarity Score:
39.64%
Best Match:
CHEMBL260374
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-7.38 -7.30 -7.18
Similarity Score:
23.86%
Best Match:
CHEMBL1814267
Prediction Result:
Inactive50.58%

ADRB2_HUMAN

Docking Scores:
-7.33 -8.19 -7.85
Similarity Score:
25.83%
Best Match:
CHEMBL15988
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-7.01 -7.92 -7.04
Similarity Score:
27.54%
Best Match:
CHEMBL1085929
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-6.73 -6.87 -6.66
Similarity Score:
30.64%
Best Match:
CHEMBL938
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-7.66 -8.17 -7.96
Similarity Score:
22.22%
Best Match:
CHEMBL406291
Prediction Result:
Inactive91.23%

CALCR_HUMAN

Docking Scores:
-6.70 -6.37 -7.26
Similarity Score:
21.50%
Best Match:
CHEMBL2369907
Prediction Result:
Inactive95.85%

CCKAR_HUMAN

Docking Scores:
-6.87 -7.03 -7.16
Similarity Score:
28.31%
Best Match:
CHEMBL2372623
Prediction Result:
Inactive98.32%

CCR1_HUMAN

Docking Scores:
-7.13 -7.80 -6.93
Similarity Score:
26.09%
Best Match:
CHEMBL358283
Prediction Result:
Inactive98.60%

CCR2_HUMAN

Docking Scores:
-6.20 -6.77 -6.21
Similarity Score:
35.14%
Best Match:
CHEMBL1829622
Prediction Result:
Inactive96.42%

CCR4_HUMAN

Docking Scores:
-6.69 -7.09 -7.44
Similarity Score:
20.73%
Best Match:
CHEMBL207780
Prediction Result:
Inactive85.49%

CCR5_HUMAN

Docking Scores:
-7.12 -6.85 -6.43
Similarity Score:
33.75%
Best Match:
CHEMBL2113088
Prediction Result:
Inactive99.56%

CLTR1_HUMAN

Docking Scores:
-7.35 -7.83 -8.27
Similarity Score:
22.40%
Best Match:
CHEMBL143515
Prediction Result:
Inactive95.48%

CNR1_HUMAN

Docking Scores:
-7.20 -7.67 -8.09
Similarity Score:
33.71%
Best Match:
CHEMBL4109469
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-7.55 -7.52
Similarity Score:
34.12%
Best Match:
CHEMBL3922495
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-7.75
Similarity Score:
18.03%
Best Match:
CHEMBL401893
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-7.79 -6.92 -6.47
Similarity Score:
23.11%
Best Match:
CHEMBL272105
Prediction Result:
Inactive74.31%

CXCR3_HUMAN

Docking Scores:
-7.47 -7.54 -7.41
Similarity Score:
26.01%
Best Match:
CHEMBL1077822
Prediction Result:
Inactive98.63%

CXCR4_HUMAN

Docking Scores:
-7.50 -6.45 -6.67
Similarity Score:
31.45%
Best Match:
CHEMBL3938247
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-6.91 -6.94 -7.57
Similarity Score:
29.67%
Best Match:
CHEMBL3697602
Prediction Result:
Inactive74.11%

DRD2_HUMAN

Docking Scores:
-7.44
Similarity Score:
31.58%
Best Match:
CHEMBL105977
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-7.11
Similarity Score:
31.58%
Best Match:
CHEMBL105977
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-7.38 -7.06
Similarity Score:
32.09%
Best Match:
CHEMBL216794
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-7.63 -7.74 -7.63
Similarity Score:
26.03%
Best Match:
CHEMBL216439
Prediction Result:
Inactive82.38%

EDNRA_HUMAN

Docking Scores:
-6.64 -6.35 -6.16
Similarity Score:
28.00%
Best Match:
CHEMBL414605
Prediction Result:
Inactive83.90%

GABR1_HUMAN

Docking Scores:
-7.01 -6.78 -5.94
Similarity Score:
16.34%
Best Match:
CHEMBL392394
Prediction Result:
Inactive89.54%

GASR_HUMAN

Docking Scores:
-6.64 -7.16 -5.53
Similarity Score:
31.03%
Best Match:
CHEMBL36436
Prediction Result:
Inactive82.98%

GRM1_HUMAN

Docking Scores:
-8.11 -8.09 -7.87
Similarity Score:
24.38%
Best Match:
CHEMBL174216
Prediction Result:
Inactive79.54%

GRM2_HUMAN

Docking Scores:
-6.90 -7.06 -7.52
Similarity Score:
29.88%
Best Match:
CHEMBL593056
Prediction Result:
Inactive75.42%

GRM3_HUMAN

Docking Scores:
-7.59 -8.34 -7.91
Similarity Score:
22.86%
Best Match:
CHEMBL3401177
Prediction Result:
Inactive74.32%

GRM4_HUMAN

Docking Scores:
-5.38 -5.51 -4.97
Similarity Score:
21.20%
Best Match:
CHEMBL3560612
Prediction Result:
Inactive95.69%

GRM5_HUMAN

Docking Scores:
-7.91 -8.38 -8.40
Similarity Score:
27.37%
Best Match:
CHEMBL1808895
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-7.12 -7.70 -6.82
Similarity Score:
21.90%
Best Match:
CHEMBL2418359
Prediction Result:
Inactive98.23%

GRM7_HUMAN

Docking Scores:
-6.67 -6.52 -6.48
Similarity Score:
21.20%
Best Match:
CHEMBL3560612
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
-6.64 -6.01 -6.73
Similarity Score:
21.90%
Best Match:
CHEMBL2418359
Prediction Result:
Inactive99.39%

HRH1_HUMAN

Docking Scores:
-7.91
Similarity Score:
45.95%
Best Match:
CHEMBL1096430
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-8.69 -7.55 -7.73
Similarity Score:
46.30%
Best Match:
CHEMBL443896
Prediction Result:
Active97.66%

HRH3_HUMAN

Docking Scores:
-7.11 -7.03 -7.09
Similarity Score:
52.69%
Best Match:
CHEMBL325327
Prediction Result:
Active71.45%

HRH4_HUMAN

Docking Scores:
-8.03 -7.70 -7.44
Similarity Score:
52.69%
Best Match:
CHEMBL325327
Prediction Result:
Active87.37%

MC3R_HUMAN

Docking Scores:
-6.75 -6.75 -5.89
Similarity Score:
32.20%
Best Match:
CHEMBL328117
Prediction Result:
Inactive69.88%

MC4R_HUMAN

Docking Scores:
-5.77 -5.81 -6.24
Similarity Score:
33.70%
Best Match:
CHEMBL3287339
Prediction Result:
Inactive78.21%

MC5R_HUMAN

Docking Scores:
-6.05 -7.28 -6.36
Similarity Score:
31.11%
Best Match:
CHEMBL313279
Prediction Result:
Active55.16%

MSHR_HUMAN

Docking Scores:
-7.80 -6.77 -6.82
Similarity Score:
32.72%
Best Match:
CHEMBL569694
Prediction Result:
Inactive62.09%

NK1R_HUMAN

Docking Scores:
-7.33 -6.89 -6.77
Similarity Score:
27.61%
Best Match:
CHEMBL393746
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-6.81 -6.89 -6.83
Similarity Score:
27.10%
Best Match:
CHEMBL307338
Prediction Result:
Inactive99.26%

NPBW1_HUMAN

Docking Scores:
-6.82 -6.86 -6.52
Similarity Score:
19.62%
Best Match:
CHEMBL1705499
Prediction Result:
Inactive96.82%

NPFF1_HUMAN

Docking Scores:
-6.45 -6.10 -6.52
Similarity Score:
27.01%
Best Match:
CHEMBL388586
Prediction Result:
Inactive84.50%

NPSR1_HUMAN

Docking Scores:
-6.58 -7.78 -7.44
Similarity Score:
22.99%
Best Match:
CHEMBL1801269
Prediction Result:
Inactive85.10%

NPY1R_HUMAN

Docking Scores:
-7.21 -7.59 -7.15
Similarity Score:
28.65%
Best Match:
CHEMBL428017
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-6.59 -6.53 -6.47
Similarity Score:
31.14%
Best Match:
CHEMBL4070864
Prediction Result:
Inactive69.15%

NPY4R_HUMAN

Docking Scores:
-7.04 -6.64 -6.70
Similarity Score:
30.86%
Best Match:
CHEMBL2440191
Prediction Result:
Active92.04%

NPY5R_HUMAN

Docking Scores:
-6.23 -6.16 -6.69
Similarity Score:
27.84%
Best Match:
CHEMBL2440182
Prediction Result:
Inactive82.17%

OPRD_HUMAN

Docking Scores:
-6.48 -5.78 -6.26
Similarity Score:
50.00%
Best Match:
CHEMBL437372
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-7.38 -7.52 -6.91
Similarity Score:
32.62%
Best Match:
CHEMBL198238
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-7.15 -7.12 -7.01
Similarity Score:
50.00%
Best Match:
CHEMBL437372
Prediction Result:
Inactive72.27%

OPRX_HUMAN

Docking Scores:
-5.91 -6.28 -6.43
Similarity Score:
29.49%
Best Match:
CHEMBL3647961
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-6.52 -6.73 -6.63
Similarity Score:
22.22%
Best Match:
CHEMBL36154
Prediction Result:
Inactive87.61%

TAAR1_HUMAN

Docking Scores:
-7.46 -7.67 -7.29
Similarity Score:
30.07%
Best Match:
CHEMBL1541237
Prediction Result:
Active67.12%

TSHR_HUMAN

Docking Scores:
-7.31 -7.77 -7.31
Similarity Score:
20.83%
Best Match:
CHEMBL3983689
Prediction Result:
Inactive95.80%

V1AR_HUMAN

Docking Scores:
-6.88 -6.52 -7.82
Similarity Score:
23.08%
Best Match:
CHEMBL41547
Prediction Result:
Inactive97.98%

VIPR1_HUMAN

Docking Scores:
-6.53 -6.79 -6.95
Similarity Score:
27.75%
Best Match:
CHEMBL3884667
Prediction Result:
N/A