suplatast #60 Output Download CSV

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

Docking Scores:
-8.25 -7.84 -8.56
Similarity Score:
39.53%
Best Match:
CHEMBL340786
Prediction Result:
Inactive50.69%

5HT1B_HUMAN

Docking Scores:
-8.36 -8.83 -9.01
Similarity Score:
39.53%
Best Match:
CHEMBL340786
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-8.38 -7.76 -7.49
Similarity Score:
39.53%
Best Match:
CHEMBL340786
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-8.72 -7.98 -9.11
Similarity Score:
28.50%
Best Match:
CHEMBL29410
Prediction Result:
Inactive73.78%

5HT1F_HUMAN

Docking Scores:
-8.58 -9.75 -8.71
Similarity Score:
35.62%
Best Match:
CHEMBL184994
Prediction Result:
Inactive51.91%

5HT2A_HUMAN

Docking Scores:
-8.83 -8.89
Similarity Score:
39.41%
Best Match:
CHEMBL3409256
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-7.97 -8.78 -9.28
Similarity Score:
39.04%
Best Match:
CHEMBL209324
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.16 -8.81
Similarity Score:
38.41%
Best Match:
CHEMBL1642865
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-9.01 -9.69 -8.04
Similarity Score:
34.39%
Best Match:
CHEMBL180680
Prediction Result:
Inactive60.12%

5HT5A_HUMAN

Docking Scores:
-8.14 -8.26 -8.39
Similarity Score:
30.91%
Best Match:
CHEMBL3326993
Prediction Result:
Inactive66.67%

5HT6R_HUMAN

Docking Scores:
-8.11 -7.93 -8.62
Similarity Score:
40.38%
Best Match:
CHEMBL3409260
Prediction Result:
Active59.08%

5HT7R_HUMAN

Docking Scores:
-8.74 -8.39 -8.91
Similarity Score:
39.41%
Best Match:
CHEMBL3409256
Prediction Result:
Active55.14%

AA1R_HUMAN

Docking Scores:
-8.03 -7.80 -7.70
Similarity Score:
33.04%
Best Match:
CHEMBL1760901
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.62 -7.97 -7.19
Similarity Score:
34.12%
Best Match:
CHEMBL201042
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-9.19 -8.63 -7.90
Similarity Score:
34.12%
Best Match:
CHEMBL201042
Prediction Result:
Inactive69.74%

AA3R_HUMAN

Docking Scores:
-0.54 -3.14 -6.04
Similarity Score:
36.59%
Best Match:
CHEMBL24
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-6.96 11.34
Similarity Score:
37.08%
Best Match:
CHEMBL2057512
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-9.36 -8.75 -7.78
Similarity Score:
41.35%
Best Match:
CHEMBL82859
Prediction Result:
Active56.04%

ACM3_HUMAN

Docking Scores:
-7.98 -8.83 -9.41
Similarity Score:
41.35%
Best Match:
CHEMBL82859
Prediction Result:
Inactive51.07%

ACM4_HUMAN

Docking Scores:
-8.21 -7.59
Similarity Score:
35.42%
Best Match:
CHEMBL71531
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-8.71 -8.88 -9.95
Similarity Score:
41.25%
Best Match:
CHEMBL3184335
Prediction Result:
Active72.42%

ACTHR_HUMAN

Docking Scores:
-8.41 -7.88 -6.87
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-8.24 -6.75 -8.36
Similarity Score:
38.58%
Best Match:
CHEMBL142635
Prediction Result:
Inactive67.18%

ADA2A_HUMAN

Docking Scores:
17.84 ? ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

ADA2B_HUMAN

Docking Scores:
-9.48 -8.04 -8.03
Similarity Score:
34.75%
Best Match:
CHEMBL518592
Prediction Result:
Active55.33%

ADA2C_HUMAN

Docking Scores:
15.32 ? ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

ADRB1_HUMAN

Docking Scores:
-8.56 -8.28 -8.93
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
Active60.53%

ADRB2_HUMAN

Docking Scores:
-8.68 -9.20 -9.43
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-8.21 -9.15 -8.15
Similarity Score:
50.34%
Best Match:
CHEMBL12943
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.38 -8.63 -8.40
Similarity Score:
28.04%
Best Match:
CHEMBL215160
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-9.36 -9.28 -9.00
Similarity Score:
34.10%
Best Match:
CHEMBL280869
Prediction Result:
Inactive71.59%

CALCR_HUMAN

Docking Scores:
-7.03 -7.84 -8.20
Similarity Score:
27.11%
Best Match:
CHEMBL2369905
Prediction Result:
Inactive98.12%

CCKAR_HUMAN

Docking Scores:
-8.06 -7.86 -9.01
Similarity Score:
35.03%
Best Match:
CHEMBL357983
Prediction Result:
Inactive93.05%

CCR1_HUMAN

Docking Scores:
-7.73 -7.71 -7.45
Similarity Score:
39.60%
Best Match:
CHEMBL2208416
Prediction Result:
Inactive93.22%

CCR2_HUMAN

Docking Scores:
-7.02 -7.34 -8.03
Similarity Score:
37.14%
Best Match:
CHEMBL246313
Prediction Result:
Inactive90.54%

CCR4_HUMAN

Docking Scores:
-7.09 -7.74 -8.61
Similarity Score:
31.28%
Best Match:
CHEMBL64391
Prediction Result:
Inactive72.48%

CCR5_HUMAN

Docking Scores:
-8.72 -7.86 -7.38
Similarity Score:
40.69%
Best Match:
CHEMBL370552
Prediction Result:
Inactive95.86%

CLTR1_HUMAN

Docking Scores:
-8.62 -9.34 -8.99
Similarity Score:
38.69%
Best Match:
CHEMBL3342949
Prediction Result:
Inactive85.60%

CNR1_HUMAN

Docking Scores:
-8.43 -8.90 -8.47
Similarity Score:
43.37%
Best Match:
CHEMBL410337
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-10.01 -9.14
Similarity Score:
42.14%
Best Match:
CHEMBL466402
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
7.41
Similarity Score:
31.44%
Best Match:
CHEMBL3426944
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-8.28 -8.15 -7.26
Similarity Score:
38.24%
Best Match:
CHEMBL3927944
Prediction Result:
Inactive59.73%

CXCR3_HUMAN

Docking Scores:
-8.36 -8.03 -8.09
Similarity Score:
37.04%
Best Match:
CHEMBL3949577
Prediction Result:
Inactive94.72%

CXCR4_HUMAN

Docking Scores:
-7.89 -7.32 -7.34
Similarity Score:
30.57%
Best Match:
CHEMBL4100900
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-8.83 -7.74 -8.22
Similarity Score:
35.93%
Best Match:
CHEMBL1112
Prediction Result:
Active54.42%

DRD2_HUMAN

Docking Scores:
-7.43
Similarity Score:
41.45%
Best Match:
CHEMBL2165124
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-8.49
Similarity Score:
41.29%
Best Match:
CHEMBL1813585
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-9.00 -9.08
Similarity Score:
41.29%
Best Match:
CHEMBL1813585
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-8.48 -9.77 -8.90
Similarity Score:
37.16%
Best Match:
CHEMBL394080
Prediction Result:
Inactive57.77%

EDNRA_HUMAN

Docking Scores:
-7.22 -7.88 -7.53
Similarity Score:
34.54%
Best Match:
CHEMBL330629
Prediction Result:
Inactive60.06%

GABR1_HUMAN

Docking Scores:
? ? ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

GASR_HUMAN

Docking Scores:
-7.55 -7.88 -7.01
Similarity Score:
35.15%
Best Match:
CHEMBL217424
Prediction Result:
Inactive81.62%

GRM1_HUMAN

Docking Scores:
-7.79 -9.19 3.14
Similarity Score:
30.57%
Best Match:
CHEMBL507522
Prediction Result:
Inactive99.99%

GRM2_HUMAN

Docking Scores:
10.43 8.86 10.84
Similarity Score:
43.66%
Best Match:
CHEMBL1098389
Prediction Result:
Inactive99.99%

GRM3_HUMAN

Docking Scores:
0.00 2.28 -5.70
Similarity Score:
32.12%
Best Match:
CHEMBL1630807
Prediction Result:
Inactive99.99%

GRM4_HUMAN

Docking Scores:
8.70 5.93 ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

GRM5_HUMAN

Docking Scores:
-9.46 -4.95 -7.67
Similarity Score:
36.71%
Best Match:
CHEMBL206427
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-1.41 -1.66 5.09
Similarity Score:
31.22%
Best Match:
CHEMBL1585091
Prediction Result:
Inactive99.99%

GRM7_HUMAN

Docking Scores:
13.55 0.93 -1.68
Similarity Score:
40.64%
Best Match:
CHEMBL3560393
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
14.71 4.42 ?
Similarity Score:
?
Best Match:
?
Prediction Result:
?

HRH1_HUMAN

Docking Scores:
-6.71
Similarity Score:
40.58%
Best Match:
CHEMBL2158830
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-10.07 -7.98 -9.05
Similarity Score:
33.14%
Best Match:
CHEMBL107293
Prediction Result:
Active96.21%

HRH3_HUMAN

Docking Scores:
-8.58 -8.80 -7.63
Similarity Score:
48.37%
Best Match:
CHEMBL240187
Prediction Result:
Active74.09%

HRH4_HUMAN

Docking Scores:
-8.76 -8.61 -8.87
Similarity Score:
30.86%
Best Match:
CHEMBL1202325
Prediction Result:
Inactive68.18%

MC3R_HUMAN

Docking Scores:
-7.69 -7.46 -7.59
Similarity Score:
34.48%
Best Match:
CHEMBL467586
Prediction Result:
Inactive67.87%

MC4R_HUMAN

Docking Scores:
-7.10 -7.24 -6.36
Similarity Score:
41.62%
Best Match:
CHEMBL1200485
Prediction Result:
Inactive88.79%

MC5R_HUMAN

Docking Scores:
-5.72 -8.33 -6.28
Similarity Score:
34.48%
Best Match:
CHEMBL467586
Prediction Result:
Inactive59.54%

MSHR_HUMAN

Docking Scores:
-7.40 -7.21 -7.91
Similarity Score:
33.00%
Best Match:
CHEMBL591037
Prediction Result:
Inactive64.90%

NK1R_HUMAN

Docking Scores:
-7.76 -8.00 -7.33
Similarity Score:
38.30%
Best Match:
CHEMBL162332
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-8.49 -8.56 -7.92
Similarity Score:
33.14%
Best Match:
CHEMBL183414
Prediction Result:
Inactive97.24%

NPBW1_HUMAN

Docking Scores:
-9.07 -8.02 -8.57
Similarity Score:
26.11%
Best Match:
CHEMBL1968640
Prediction Result:
Inactive85.24%

NPFF1_HUMAN

Docking Scores:
-7.93 -8.17 -8.46
Similarity Score:
32.70%
Best Match:
CHEMBL3361420
Prediction Result:
Inactive60.03%

NPSR1_HUMAN

Docking Scores:
-8.30 -9.59 -9.18
Similarity Score:
29.56%
Best Match:
CHEMBL1801361
Prediction Result:
Inactive69.79%

NPY1R_HUMAN

Docking Scores:
-8.71 -8.31 -7.85
Similarity Score:
34.00%
Best Match:
CHEMBL329997
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-7.93 -7.95 -7.85
Similarity Score:
38.61%
Best Match:
CHEMBL3104195
Prediction Result:
Inactive96.45%

NPY4R_HUMAN

Docking Scores:
-8.09 -9.02 -8.48
Similarity Score:
29.66%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive91.32%

NPY5R_HUMAN

Docking Scores:
-8.09 -7.26 -7.36
Similarity Score:
39.84%
Best Match:
CHEMBL76661
Prediction Result:
Inactive79.66%

OPRD_HUMAN

Docking Scores:
-7.23 -5.68 -7.05
Similarity Score:
40.27%
Best Match:
CHEMBL2079638
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-8.77 -7.70 -8.09
Similarity Score:
36.36%
Best Match:
CHEMBL1258503
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-8.04 -6.57 -7.43
Similarity Score:
36.36%
Best Match:
CHEMBL1258503
Prediction Result:
Inactive82.82%

OPRX_HUMAN

Docking Scores:
-7.68 -7.73 -7.75
Similarity Score:
35.50%
Best Match:
CHEMBL2064132
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-8.29 -8.40 -7.99
Similarity Score:
31.25%
Best Match:
CHEMBL54106
Prediction Result:
Inactive69.87%

TAAR1_HUMAN

Docking Scores:
-9.10 -8.93 -8.59
Similarity Score:
47.90%
Best Match:
CHEMBL1490462
Prediction Result:
Active51.78%

TSHR_HUMAN

Docking Scores:
-8.03 -8.26 -8.82
Similarity Score:
37.58%
Best Match:
CHEMBL3913851
Prediction Result:
Inactive89.49%

V1AR_HUMAN

Docking Scores:
-8.56 -8.05 -8.10
Similarity Score:
40.13%
Best Match:
CHEMBL3416769
Prediction Result:
Inactive70.63%

VIPR1_HUMAN

Docking Scores:
-7.81 -7.68 -8.97
Similarity Score:
25.11%
Best Match:
CHEMBL524852
Prediction Result:
N/A