CBD #47 Output Download CSV

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

Docking Scores:
-7.73 -7.28 -7.71
Similarity Score:
49.40%
Best Match:
CHEMBL146942
Prediction Result:
Active54.27%

5HT1B_HUMAN

Docking Scores:
-8.29 -8.27 -8.87
Similarity Score:
49.40%
Best Match:
CHEMBL146942
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-8.57 -8.53 -8.07
Similarity Score:
40.82%
Best Match:
CHEMBL26998
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-7.73 -7.70 -7.67
Similarity Score:
27.39%
Best Match:
CHEMBL22744
Prediction Result:
Active59.03%

5HT1F_HUMAN

Docking Scores:
-7.93 -8.12 -8.55
Similarity Score:
23.81%
Best Match:
CHEMBL497963
Prediction Result:
Inactive67.89%

5HT2A_HUMAN

Docking Scores:
-9.25 -8.22
Similarity Score:
46.74%
Best Match:
CHEMBL268890
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-7.83 -8.33 -7.80
Similarity Score:
41.98%
Best Match:
CHEMBL510383
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.49 -8.63
Similarity Score:
41.98%
Best Match:
CHEMBL510383
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-8.28 -8.80 -8.66
Similarity Score:
31.06%
Best Match:
CHEMBL84398
Prediction Result:
Inactive83.03%

5HT5A_HUMAN

Docking Scores:
-8.16 -7.15 -8.07
Similarity Score:
36.70%
Best Match:
CHEMBL278751
Prediction Result:
Inactive59.09%

5HT6R_HUMAN

Docking Scores:
-8.65 -7.87 -8.61
Similarity Score:
49.40%
Best Match:
CHEMBL146942
Prediction Result:
Active78.40%

5HT7R_HUMAN

Docking Scores:
-7.82 -8.74 -8.48
Similarity Score:
49.40%
Best Match:
CHEMBL146942
Prediction Result:
Active72.23%

AA1R_HUMAN

Docking Scores:
-8.10 -8.08 -8.65
Similarity Score:
26.67%
Best Match:
CHEMBL103150
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.93 -7.96 -8.29
Similarity Score:
27.00%
Best Match:
CHEMBL496
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-7.99 -8.79 -7.87
Similarity Score:
21.56%
Best Match:
CHEMBL3317578
Prediction Result:
Inactive82.72%

AA3R_HUMAN

Docking Scores:
-8.74 -6.38 -8.87
Similarity Score:
40.82%
Best Match:
CHEMBL56
Prediction Result:
Inactive63.64%

ACM1_HUMAN

Docking Scores:
-9.17 -5.09
Similarity Score:
41.90%
Best Match:
CHEMBL3085495
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-8.58 -7.99 -9.89
Similarity Score:
41.90%
Best Match:
CHEMBL3085495
Prediction Result:
Active65.74%

ACM3_HUMAN

Docking Scores:
-8.13 -9.41 -9.00
Similarity Score:
41.90%
Best Match:
CHEMBL3085495
Prediction Result:
Active51.18%

ACM4_HUMAN

Docking Scores:
-9.23 -8.61
Similarity Score:
41.90%
Best Match:
CHEMBL3085495
Prediction Result:
N/A

ACM5_HUMAN

Docking Scores:
-9.22 -9.57 -8.67
Similarity Score:
32.99%
Best Match:
CHEMBL27673
Prediction Result:
Active62.87%

ACTHR_HUMAN

Docking Scores:
-8.72 -8.58 -8.40
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-8.45 -8.12 -9.02
Similarity Score:
40.82%
Best Match:
CHEMBL56
Prediction Result:
Inactive65.06%

ADA2A_HUMAN

Docking Scores:
-7.00 -5.57 -4.98
Similarity Score:
34.75%
Best Match:
CHEMBL256984
Prediction Result:
Active53.20%

ADA2B_HUMAN

Docking Scores:
-8.62 -9.52 -8.27
Similarity Score:
32.18%
Best Match:
CHEMBL1437
Prediction Result:
Active53.34%

ADA2C_HUMAN

Docking Scores:
-2.17 -1.70 0.49
Similarity Score:
32.81%
Best Match:
CHEMBL50588
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-8.85 -8.16 -9.37
Similarity Score:
32.48%
Best Match:
CHEMBL26917
Prediction Result:
Inactive70.85%

ADRB2_HUMAN

Docking Scores:
-8.21 -9.63 -9.01
Similarity Score:
37.89%
Best Match:
CHEMBL1800960
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-8.91 -8.85 -8.73
Similarity Score:
32.18%
Best Match:
CHEMBL1437
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.25 -8.51 -8.20
Similarity Score:
25.84%
Best Match:
CHEMBL154057
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-8.93 -8.78 -9.07
Similarity Score:
20.73%
Best Match:
CHEMBL1162797
Prediction Result:
Inactive88.64%

CALCR_HUMAN

Docking Scores:
-7.72 -7.82 -8.29
Similarity Score:
19.10%
Best Match:
CHEMBL2369895
Prediction Result:
Inactive98.48%

CCKAR_HUMAN

Docking Scores:
-8.17 -7.16 -8.24
Similarity Score:
20.27%
Best Match:
CHEMBL250974
Prediction Result:
Inactive98.20%

CCR1_HUMAN

Docking Scores:
-8.26 -7.41 -7.26
Similarity Score:
33.33%
Best Match:
CHEMBL341840
Prediction Result:
Inactive94.99%

CCR2_HUMAN

Docking Scores:
-6.67 -8.25 -7.16
Similarity Score:
51.58%
Best Match:
CHEMBL3754764
Prediction Result:
Inactive79.00%

CCR4_HUMAN

Docking Scores:
-7.26 -7.39 -7.54
Similarity Score:
25.89%
Best Match:
CHEMBL1618631
Prediction Result:
Inactive80.62%

CCR5_HUMAN

Docking Scores:
-7.96 -8.04 -7.62
Similarity Score:
34.82%
Best Match:
CHEMBL468150
Prediction Result:
Inactive91.75%

CLTR1_HUMAN

Docking Scores:
-8.12 -8.70 -8.96
Similarity Score:
30.07%
Best Match:
CHEMBL1213917
Prediction Result:
Inactive92.41%

CNR1_HUMAN

Docking Scores:
-7.64 -8.55 -9.38
Similarity Score:
98.61%
Best Match:
CHEMBL394305
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-8.92 -9.44
Similarity Score:
100.00%
Best Match:
CHEMBL236171
Prediction Result:
N/A

CXCR1_HUMAN

Docking Scores:
-6.53
Similarity Score:
24.71%
Best Match:
CHEMBL254370
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-7.41 -6.70 -6.57
Similarity Score:
28.06%
Best Match:
CHEMBL3645131
Prediction Result:
Inactive70.37%

CXCR3_HUMAN

Docking Scores:
-7.87 -8.06 -7.99
Similarity Score:
32.26%
Best Match:
CHEMBL2205064
Prediction Result:
Inactive96.43%

CXCR4_HUMAN

Docking Scores:
-7.19 -6.79 -7.11
Similarity Score:
32.14%
Best Match:
CHEMBL126657
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-8.57 -7.87 -7.85
Similarity Score:
42.86%
Best Match:
CHEMBL2092940
Prediction Result:
Active51.09%

DRD2_HUMAN

Docking Scores:
-7.19
Similarity Score:
42.86%
Best Match:
CHEMBL1159663
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-7.44
Similarity Score:
62.75%
Best Match:
CHEMBL4082631
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-8.03 -8.64
Similarity Score:
40.82%
Best Match:
CHEMBL334472
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-8.57 -8.81 -7.89
Similarity Score:
33.87%
Best Match:
CHEMBL604314
Prediction Result:
Inactive64.89%

EDNRA_HUMAN

Docking Scores:
-7.23 -6.98 -7.03
Similarity Score:
36.73%
Best Match:
CHEMBL10832
Prediction Result:
Inactive50.64%

GABR1_HUMAN

Docking Scores:
-4.54 -4.99 2.51
Similarity Score:
20.28%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive99.99%

GASR_HUMAN

Docking Scores:
-8.51 -7.32 -5.81
Similarity Score:
24.46%
Best Match:
CHEMBL452991
Prediction Result:
Inactive80.01%

GRM1_HUMAN

Docking Scores:
-7.32 -9.06 -7.26
Similarity Score:
33.65%
Best Match:
CHEMBL254372
Prediction Result:
Inactive67.80%

GRM2_HUMAN

Docking Scores:
-5.64 -6.40 -5.33
Similarity Score:
34.58%
Best Match:
CHEMBL341457
Prediction Result:
Inactive65.74%

GRM3_HUMAN

Docking Scores:
-5.32 -7.61 -8.47
Similarity Score:
37.00%
Best Match:
CHEMBL124483
Prediction Result:
Inactive96.20%

GRM4_HUMAN

Docking Scores:
-2.77 -3.02 -2.54
Similarity Score:
20.30%
Best Match:
CHEMBL2063423
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-9.83 -6.99 -6.88
Similarity Score:
34.58%
Best Match:
CHEMBL1289626
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-7.48 -8.19 -7.86
Similarity Score:
12.95%
Best Match:
CHEMBL4101970
Prediction Result:
Inactive98.68%

GRM7_HUMAN

Docking Scores:
-2.92 -4.30 -2.40
Similarity Score:
30.58%
Best Match:
CHEMBL432038
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
-2.23 -2.12 -2.07
Similarity Score:
30.58%
Best Match:
CHEMBL432038
Prediction Result:
Inactive99.99%

HRH1_HUMAN

Docking Scores:
-6.01
Similarity Score:
41.90%
Best Match:
CHEMBL1101
Prediction Result:
N/A

HRH2_HUMAN

Docking Scores:
-9.21 -8.16 -8.52
Similarity Score:
31.75%
Best Match:
CHEMBL490632
Prediction Result:
Active95.81%

HRH3_HUMAN

Docking Scores:
-8.13 -8.25 -7.89
Similarity Score:
37.74%
Best Match:
CHEMBL2375595
Prediction Result:
Active55.46%

HRH4_HUMAN

Docking Scores:
-7.90 -7.83 -8.08
Similarity Score:
33.67%
Best Match:
CHEMBL1934066
Prediction Result:
Inactive54.75%

MC3R_HUMAN

Docking Scores:
-8.65 -8.80 -7.51
Similarity Score:
24.18%
Best Match:
CHEMBL193715
Prediction Result:
Inactive65.41%

MC4R_HUMAN

Docking Scores:
-7.11 -6.72 -7.31
Similarity Score:
39.22%
Best Match:
CHEMBL1699592
Prediction Result:
Inactive86.05%

MC5R_HUMAN

Docking Scores:
-6.25 -7.67 -4.85
Similarity Score:
25.00%
Best Match:
CHEMBL3913861
Prediction Result:
Inactive90.35%

MSHR_HUMAN

Docking Scores:
-7.99 -7.85 -8.33
Similarity Score:
23.13%
Best Match:
CHEMBL379054
Prediction Result:
Inactive76.99%

NK1R_HUMAN

Docking Scores:
-7.65 -7.87 -7.68
Similarity Score:
40.98%
Best Match:
CHEMBL2114439
Prediction Result:
N/A

NK2R_HUMAN

Docking Scores:
-8.10 -8.30 -8.02
Similarity Score:
29.59%
Best Match:
CHEMBL17157
Prediction Result:
Inactive98.32%

NPBW1_HUMAN

Docking Scores:
-7.44 -7.28 -7.10
Similarity Score:
21.98%
Best Match:
CHEMBL1940539
Prediction Result:
Inactive96.04%

NPFF1_HUMAN

Docking Scores:
-7.30 -7.07 -7.17
Similarity Score:
26.45%
Best Match:
CHEMBL3361424
Prediction Result:
Inactive93.87%

NPSR1_HUMAN

Docking Scores:
-8.21 -8.18 -8.07
Similarity Score:
22.66%
Best Match:
CHEMBL3086828
Prediction Result:
Inactive78.41%

NPY1R_HUMAN

Docking Scores:
-9.06 -8.36 -7.47
Similarity Score:
32.46%
Best Match:
CHEMBL556915
Prediction Result:
N/A

NPY2R_HUMAN

Docking Scores:
-7.54 -8.22 -7.47
Similarity Score:
28.42%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive96.96%

NPY4R_HUMAN

Docking Scores:
-7.98 -8.49 -8.02
Similarity Score:
28.42%
Best Match:
CHEMBL3559801
Prediction Result:
Inactive71.65%

NPY5R_HUMAN

Docking Scores:
-7.65 -7.51 -7.44
Similarity Score:
45.00%
Best Match:
CHEMBL469257
Prediction Result:
Inactive85.48%

OPRD_HUMAN

Docking Scores:
-7.14 -6.74 -6.98
Similarity Score:
45.54%
Best Match:
CHEMBL437949
Prediction Result:
N/A

OPRK_HUMAN

Docking Scores:
-8.68 -9.16 -7.97
Similarity Score:
45.54%
Best Match:
CHEMBL437949
Prediction Result:
N/A

OPRM_HUMAN

Docking Scores:
-8.03 -7.89 -7.13
Similarity Score:
45.54%
Best Match:
CHEMBL437949
Prediction Result:
Inactive59.36%

OPRX_HUMAN

Docking Scores:
-7.56 -7.51 -7.81
Similarity Score:
37.50%
Best Match:
CHEMBL3785718
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-8.04 -8.30 -7.67
Similarity Score:
37.74%
Best Match:
CHEMBL297624
Prediction Result:
Inactive56.10%

TAAR1_HUMAN

Docking Scores:
-9.19 -8.75 -8.43
Similarity Score:
33.75%
Best Match:
CHEMBL1200705
Prediction Result:
Active62.09%

TSHR_HUMAN

Docking Scores:
-8.66 -9.61 -8.28
Similarity Score:
23.56%
Best Match:
CHEMBL3897841
Prediction Result:
Inactive97.26%

V1AR_HUMAN

Docking Scores:
-8.17 -7.26 -8.29
Similarity Score:
33.77%
Best Match:
CHEMBL430676
Prediction Result:
Inactive82.09%

VIPR1_HUMAN

Docking Scores:
-7.74 -8.00 -8.22
Similarity Score:
18.23%
Best Match:
CHEMBL483749
Prediction Result:
N/A