anti-pain drug v2 #221 Output Download CSV
The docking scores are in the AutoDock Vina metric.
5HT1B_HUMAN
Docking Scores:
-5.93
-6.16
-6.49
Similarity Score:
43.48%
Best Match:
CHEMBL2112766
5HT1B_HUMAN
Docking Scores:
-6.01
-6.05
-5.73
Similarity Score:
32.93%
Best Match:
CHEMBL110317
5HT1B_HUMAN
Docking Scores:
-9.91
-10.09
-10.51
Similarity Score:
38.99%
Best Match:
CHEMBL97637
5HT1B_HUMAN
Docking Scores:
-7.40
-7.59
-7.37
Similarity Score:
29.03%
Best Match:
CHEMBL3126382
5HT1B_HUMAN
Docking Scores:
-7.43
-7.35
-7.88
Similarity Score:
40.91%
Best Match:
CHEMBL191460
5HT2A_HUMAN
Docking Scores:
-6.45
-6.45
Similarity Score:
43.42%
Best Match:
CHEMBL272942
5HT2A_HUMAN
Docking Scores:
-5.66
-5.84
Similarity Score:
38.75%
Best Match:
CHEMBL698
5HT2A_HUMAN
Docking Scores:
-10.32
-10.60
Similarity Score:
39.22%
Best Match:
CHEMBL395501
5HT2A_HUMAN
Docking Scores:
-7.68
-7.42
Similarity Score:
36.54%
Best Match:
CHEMBL1201203
5HT2A_HUMAN
Docking Scores:
-6.95
-7.44
Similarity Score:
52.63%
Best Match:
CHEMBL443128
5HT2B_HUMAN
Docking Scores:
-6.36
-6.53
-6.65
Similarity Score:
44.62%
Best Match:
CHEMBL558
5HT2B_HUMAN
Docking Scores:
-6.53
-6.35
-6.49
Similarity Score:
32.99%
Best Match:
CHEMBL86
5HT2B_HUMAN
Docking Scores:
-9.50
-9.80
-10.25
Similarity Score:
35.07%
Best Match:
CHEMBL88571
5HT2B_HUMAN
Docking Scores:
-7.27
-7.02
-7.85
Similarity Score:
36.54%
Best Match:
CHEMBL1201203
5HT2B_HUMAN
Docking Scores:
-7.04
-6.61
-6.86
Similarity Score:
58.89%
Best Match:
CHEMBL1909048
5HT2C_HUMAN
Docking Scores:
-6.40
-6.78
Similarity Score:
43.42%
Best Match:
CHEMBL272942
5HT2C_HUMAN
Docking Scores:
-6.02
-5.68
Similarity Score:
32.53%
Best Match:
CHEMBL194588
5HT2C_HUMAN
Docking Scores:
-9.56
-9.93
Similarity Score:
39.22%
Best Match:
CHEMBL395501
5HT2C_HUMAN
Docking Scores:
-7.07
-7.45
Similarity Score:
36.54%
Best Match:
CHEMBL1201203
5HT2C_HUMAN
Docking Scores:
-6.73
-8.32
Similarity Score:
56.84%
Best Match:
CHEMBL1092029
AA1R_HUMAN
Docking Scores:
-5.58
-5.62
-6.41
Similarity Score:
32.77%
Best Match:
CHEMBL2151131
AA1R_HUMAN
Docking Scores:
-5.24
-5.57
-5.79
Similarity Score:
38.10%
Best Match:
CHEMBL196375
AA1R_HUMAN
Docking Scores:
-9.15
-8.38
-8.45
Similarity Score:
43.50%
Best Match:
CHEMBL208705
AA1R_HUMAN
Docking Scores:
-7.37
-7.06
-7.16
Similarity Score:
28.73%
Best Match:
CHEMBL596460
AA1R_HUMAN
Docking Scores:
-7.53
-6.86
-7.05
Similarity Score:
34.15%
Best Match:
CHEMBL2435536
AA2AR_HUMAN
Docking Scores:
-5.99
-5.92
-6.00
Similarity Score:
32.79%
Best Match:
CHEMBL197359
AA2AR_HUMAN
Docking Scores:
-5.16
-5.72
-5.74
Similarity Score:
39.13%
Best Match:
CHEMBL600008
AA2AR_HUMAN
Docking Scores:
-8.47
-8.50
-9.23
Similarity Score:
36.20%
Best Match:
CHEMBL196375
AA2AR_HUMAN
Docking Scores:
-6.33
-6.60
-7.72
Similarity Score:
28.73%
Best Match:
CHEMBL596460
AA2AR_HUMAN
Docking Scores:
-7.51
-7.54
-8.12
Similarity Score:
32.58%
Best Match:
CHEMBL2368363
ACES_HUMAN
Docking Scores:
-6.60
-6.51
-7.23
Similarity Score:
52.78%
Best Match:
CHEMBL139330
ACES_HUMAN
Docking Scores:
-6.06
-6.37
-6.60
Similarity Score:
43.18%
Best Match:
CHEMBL58521
ACES_HUMAN
Docking Scores:
-10.12
-9.81
-9.03
Similarity Score:
37.10%
Best Match:
CHEMBL477772
ACES_HUMAN
Docking Scores:
-8.59
-7.95
-7.17
Similarity Score:
37.88%
Best Match:
CHEMBL1783526
ACES_HUMAN
Docking Scores:
-7.99
-7.52
-7.68
Similarity Score:
63.41%
Best Match:
CHEMBL552832
ACE_HUMAN
Docking Scores:
-5.96
-6.16
-5.95
Similarity Score:
29.69%
Best Match:
CHEMBL254493
ACE_HUMAN
Docking Scores:
-5.98
-5.55
-5.25
Similarity Score:
25.47%
Best Match:
CHEMBL457317
ACE_HUMAN
Docking Scores:
-9.48
-9.29
-8.20
Similarity Score:
31.50%
Best Match:
CHEMBL514138
ACE_HUMAN
Docking Scores:
-6.82
-6.96
-6.78
Similarity Score:
42.97%
Best Match:
CHEMBL1907755
ACE_HUMAN
Docking Scores:
-6.52
-6.67
-6.18
Similarity Score:
48.67%
Best Match:
CHEMBL435360
ACHA9_HUMAN
Docking Scores:
-7.43
Similarity Score:
21.40%
Best Match:
CHEMBL386114
ACHA9_HUMAN
Docking Scores:
-5.68
Similarity Score:
22.46%
Best Match:
CHEMBL386114
ACHB2_HUMAN
Docking Scores:
-7.55
-7.37
-6.59
Similarity Score:
N/A
Best Match:
N/A
ACHB2_HUMAN
Docking Scores:
-4.37
-4.32
-4.62
Similarity Score:
N/A
Best Match:
N/A
ACM1_HUMAN
Docking Scores:
-6.75
-6.89
Similarity Score:
40.26%
Best Match:
CHEMBL4102555
ACM1_HUMAN
Docking Scores:
-5.96
-6.55
Similarity Score:
38.00%
Best Match:
CHEMBL608112
ACM1_HUMAN
Docking Scores:
-7.52
0.73
Similarity Score:
32.93%
Best Match:
CHEMBL3290084
ACM1_HUMAN
Docking Scores:
-7.94
-0.04
Similarity Score:
53.93%
Best Match:
CHEMBL170977
ACM4_HUMAN
Docking Scores:
-9.27
-8.10
Similarity Score:
31.85%
Best Match:
CHEMBL1455766
ACM4_HUMAN
Docking Scores:
-7.50
-7.29
Similarity Score:
39.13%
Best Match:
CHEMBL2146598
ADRB2_HUMAN
Docking Scores:
-6.71
-6.84
-6.72
Similarity Score:
46.59%
Best Match:
CHEMBL1704973
ADRB2_HUMAN
Docking Scores:
-6.22
-6.71
-6.38
Similarity Score:
42.22%
Best Match:
CHEMBL3290996
ADRB2_HUMAN
Docking Scores:
-10.02
-10.76
-10.61
Similarity Score:
53.85%
Best Match:
CHEMBL1557985
ADRB2_HUMAN
Docking Scores:
-6.35
-6.29
-7.54
Similarity Score:
31.34%
Best Match:
CHEMBL1083363
ADRB2_HUMAN
Docking Scores:
-6.86
-7.85
-6.97
Similarity Score:
48.48%
Best Match:
CHEMBL1524289
AGTR2_HUMAN
Docking Scores:
-5.94
-6.11
-6.00
Similarity Score:
26.25%
Best Match:
CHEMBL158557
AGTR2_HUMAN
Docking Scores:
-5.22
-5.20
-5.37
Similarity Score:
24.32%
Best Match:
CHEMBL376286
AGTR2_HUMAN
Docking Scores:
-9.13
-9.15
-8.74
Similarity Score:
30.21%
Best Match:
CHEMBL346728
AGTR2_HUMAN
Docking Scores:
-6.93
-6.79
-6.70
Similarity Score:
25.60%
Best Match:
CHEMBL190286
AGTR2_HUMAN
Docking Scores:
-6.92
-6.75
-6.77
Similarity Score:
38.02%
Best Match:
CHEMBL128416
ALDR_HUMAN
Docking Scores:
-7.22
-7.08
-7.23
Similarity Score:
43.52%
Best Match:
CHEMBL110030
ALDR_HUMAN
Docking Scores:
-6.86
-5.85
-6.90
Similarity Score:
34.18%
Best Match:
CHEMBL51483
ALDR_HUMAN
Docking Scores:
-9.76
-9.69
-11.07
Similarity Score:
33.54%
Best Match:
CHEMBL282245
ALDR_HUMAN
Docking Scores:
-7.41
-6.62
-7.48
Similarity Score:
20.54%
Best Match:
CHEMBL139666
ALDR_HUMAN
Docking Scores:
-7.08
-7.10
-7.47
Similarity Score:
38.89%
Best Match:
CHEMBL278584
AMPN_HUMAN
Docking Scores:
-5.66
-6.67
-6.27
Similarity Score:
25.00%
Best Match:
CHEMBL3805817
AMPN_HUMAN
Docking Scores:
-5.80
-6.09
-5.82
Similarity Score:
20.65%
Best Match:
CHEMBL3805817
AMPN_HUMAN
Docking Scores:
-9.23
-9.15
-8.93
Similarity Score:
22.65%
Best Match:
CHEMBL1077591
AMPN_HUMAN
Docking Scores:
-6.92
-7.35
-6.97
Similarity Score:
34.62%
Best Match:
CHEMBL3298945
AMPN_HUMAN
Docking Scores:
-6.77
-7.43
-7.28
Similarity Score:
45.79%
Best Match:
CHEMBL2332518
AOFA_HUMAN
Docking Scores:
-6.45
-6.62
-6.98
Similarity Score:
45.88%
Best Match:
CHEMBL2391739
AOFA_HUMAN
Docking Scores:
-6.29
-6.22
-6.14
Similarity Score:
36.90%
Best Match:
CHEMBL2391739
AOFA_HUMAN
Docking Scores:
-10.14
-10.36
-10.97
Similarity Score:
28.42%
Best Match:
CHEMBL1258719
AOFA_HUMAN
Docking Scores:
-7.09
-7.44
-6.97
Similarity Score:
26.87%
Best Match:
CHEMBL4072860
AOFA_HUMAN
Docking Scores:
-8.23
-8.16
-8.14
Similarity Score:
41.98%
Best Match:
CHEMBL3330339
AOFB_HUMAN
Docking Scores:
-6.78
-6.62
-6.63
Similarity Score:
53.73%
Best Match:
CHEMBL3278090
AOFB_HUMAN
Docking Scores:
-6.24
-6.16
-6.36
Similarity Score:
45.78%
Best Match:
CHEMBL3769905
AOFB_HUMAN
Docking Scores:
-10.66
-11.03
-10.70
Similarity Score:
29.61%
Best Match:
CHEMBL3319255
AOFB_HUMAN
Docking Scores:
-7.64
-6.91
-7.14
Similarity Score:
31.86%
Best Match:
CHEMBL597372
AOFB_HUMAN
Docking Scores:
-7.97
-8.09
-8.48
Similarity Score:
46.25%
Best Match:
CHEMBL2094026
BACE1_HUMAN
Docking Scores:
-5.11
-5.52
-5.98
Similarity Score:
35.64%
Best Match:
CHEMBL3586198
BACE1_HUMAN
Docking Scores:
-5.24
-4.95
-5.39
Similarity Score:
34.88%
Best Match:
CHEMBL3586204
BACE1_HUMAN
Docking Scores:
-7.30
-8.24
-8.55
Similarity Score:
36.63%
Best Match:
CHEMBL1210351
BACE1_HUMAN
Docking Scores:
-6.11
-6.65
-7.10
Similarity Score:
41.33%
Best Match:
CHEMBL1917912
BACE1_HUMAN
Docking Scores:
-5.85
-5.87
-6.83
Similarity Score:
49.61%
Best Match:
CHEMBL2011990
CAH2_HUMAN
Docking Scores:
-6.29
-6.27
-6.25
Similarity Score:
59.32%
Best Match:
CHEMBL2333586
CAH2_HUMAN
Docking Scores:
-6.28
-6.27
-5.96
Similarity Score:
63.46%
Best Match:
CHEMBL2333586
CAH2_HUMAN
Docking Scores:
-8.28
-8.30
-7.83
Similarity Score:
53.12%
Best Match:
CHEMBL2164736
CAH2_HUMAN
Docking Scores:
-6.53
-6.55
-6.41
Similarity Score:
30.93%
Best Match:
CHEMBL3400807
CAH2_HUMAN
Docking Scores:
-7.48
-7.36
-6.72
Similarity Score:
41.46%
Best Match:
CHEMBL206830
CASP1_HUMAN
Docking Scores:
-4.81
-5.70
-4.75
Similarity Score:
39.20%
Best Match:
CHEMBL101145
CASP1_HUMAN
Docking Scores:
-4.97
-5.38
-5.54
Similarity Score:
26.42%
Best Match:
CHEMBL597796
CASP1_HUMAN
Docking Scores:
-7.91
-7.84
-7.29
Similarity Score:
34.62%
Best Match:
CHEMBL422849
CASP1_HUMAN
Docking Scores:
-5.35
-5.87
-4.95
Similarity Score:
32.79%
Best Match:
CHEMBL221870
CASP1_HUMAN
Docking Scores:
-5.98
-6.06
-4.75
Similarity Score:
48.96%
Best Match:
CHEMBL466565
CDK5_HUMAN
Docking Scores:
-6.17
-6.63
-6.92
Similarity Score:
36.19%
Best Match:
CHEMBL2007296
CDK5_HUMAN
Docking Scores:
-5.81
-6.05
-6.45
Similarity Score:
42.86%
Best Match:
CHEMBL1986666
CDK5_HUMAN
Docking Scores:
-8.09
-8.03
-9.16
Similarity Score:
40.88%
Best Match:
CHEMBL2004892
CDK5_HUMAN
Docking Scores:
-6.77
-7.69
-5.90
Similarity Score:
22.22%
Best Match:
CHEMBL1969843
CDK5_HUMAN
Docking Scores:
-6.50
-6.74
-6.29
Similarity Score:
37.07%
Best Match:
CHEMBL1982413
CHLE_HUMAN
Docking Scores:
-6.69
-6.27
-6.40
Similarity Score:
36.79%
Best Match:
CHEMBL544592
CHLE_HUMAN
Docking Scores:
-6.04
-5.98
-6.16
Similarity Score:
32.69%
Best Match:
CHEMBL577112
CHLE_HUMAN
Docking Scores:
-8.62
-8.90
-8.84
Similarity Score:
28.63%
Best Match:
CHEMBL3925612
CHLE_HUMAN
Docking Scores:
-7.54
-7.48
-7.81
Similarity Score:
37.88%
Best Match:
CHEMBL1783526
CHLE_HUMAN
Docking Scores:
-7.26
-6.93
-7.20
Similarity Score:
42.86%
Best Match:
CHEMBL174710
CNR1_HUMAN
Docking Scores:
-5.65
-6.37
-6.45
Similarity Score:
47.83%
Best Match:
CHEMBL243334
CNR1_HUMAN
Docking Scores:
-4.87
-6.19
-6.09
Similarity Score:
38.81%
Best Match:
CHEMBL243334
CNR1_HUMAN
Docking Scores:
-10.11
-10.90
-9.35
Similarity Score:
41.81%
Best Match:
CHEMBL247332
CNR1_HUMAN
Docking Scores:
-7.83
-7.87
-7.65
Similarity Score:
39.29%
Best Match:
CHEMBL1800731
CNR1_HUMAN
Docking Scores:
-7.99
-6.78
-7.30
Similarity Score:
56.44%
Best Match:
CHEMBL1095690
CNR2_HUMAN
Docking Scores:
-5.68
-5.62
Similarity Score:
38.81%
Best Match:
CHEMBL243334
CNR2_HUMAN
Docking Scores:
-9.87
-10.07
Similarity Score:
39.57%
Best Match:
CHEMBL245876
CNR2_HUMAN
Docking Scores:
-8.20
-8.44
Similarity Score:
39.29%
Best Match:
CHEMBL1800731
CNR2_HUMAN
Docking Scores:
-7.95
-7.64
Similarity Score:
56.44%
Best Match:
CHEMBL1095690
COLI_HUMAN
Docking Scores:
-7.12
-6.91
-6.51
Similarity Score:
N/A
Best Match:
N/A
COMT_HUMAN
Docking Scores:
-5.38
-5.25
-5.76
Similarity Score:
25.62%
Best Match:
CHEMBL3980370
COMT_HUMAN
Docking Scores:
-5.32
-4.99
-5.81
Similarity Score:
37.36%
Best Match:
CHEMBL1324
COMT_HUMAN
Docking Scores:
-6.43
-6.32
-6.82
Similarity Score:
29.78%
Best Match:
CHEMBL3798524
COMT_HUMAN
Docking Scores:
-5.09
-5.17
-4.98
Similarity Score:
26.48%
Best Match:
CHEMBL3819488
COMT_HUMAN
Docking Scores:
-4.80
-5.61
-4.69
Similarity Score:
27.94%
Best Match:
CHEMBL3425731
CXCR1_HUMAN
Docking Scores:
-4.95
Similarity Score:
27.86%
Best Match:
CHEMBL376621
CXCR1_HUMAN
Docking Scores:
-4.38
Similarity Score:
21.35%
Best Match:
CHEMBL3891755
CXCR4_HUMAN
Docking Scores:
-6.56
-5.81
-5.82
Similarity Score:
30.00%
Best Match:
CHEMBL126657
CXCR4_HUMAN
Docking Scores:
-5.98
-5.83
-5.68
Similarity Score:
27.37%
Best Match:
CHEMBL126657
CXCR4_HUMAN
Docking Scores:
-8.85
-7.91
-7.49
Similarity Score:
28.44%
Best Match:
CHEMBL4100900
CXCR4_HUMAN
Docking Scores:
-6.94
-5.96
-7.15
Similarity Score:
30.11%
Best Match:
CHEMBL2170299
CXCR4_HUMAN
Docking Scores:
-7.83
-5.28
-7.24
Similarity Score:
41.18%
Best Match:
CHEMBL2170299
DRD2_HUMAN
Docking Scores:
-10.06
Similarity Score:
39.47%
Best Match:
CHEMBL231326
DRD2_HUMAN
Docking Scores:
-6.72
Similarity Score:
37.14%
Best Match:
CHEMBL3799986
DRD3_HUMAN
Docking Scores:
-6.78
Similarity Score:
36.54%
Best Match:
CHEMBL1201203
DRD4_HUMAN
Docking Scores:
-6.59
-6.22
Similarity Score:
35.37%
Best Match:
CHEMBL184772
DRD4_HUMAN
Docking Scores:
-10.37
-10.44
Similarity Score:
33.33%
Best Match:
CHEMBL3409256
DRD4_HUMAN
Docking Scores:
-7.71
-7.53
Similarity Score:
36.61%
Best Match:
CHEMBL351611
ESR1_HUMAN
Docking Scores:
-6.08
-5.90
-5.70
Similarity Score:
63.08%
Best Match:
CHEMBL1082743
ESR1_HUMAN
Docking Scores:
-5.85
-5.91
-5.78
Similarity Score:
46.15%
Best Match:
CHEMBL2071180
ESR1_HUMAN
Docking Scores:
-8.95
-8.43
-8.64
Similarity Score:
41.84%
Best Match:
CHEMBL202691
ESR1_HUMAN
Docking Scores:
-7.68
-7.16
-7.65
Similarity Score:
40.16%
Best Match:
CHEMBL1627354
ESR1_HUMAN
Docking Scores:
-7.58
-7.35
-7.31
Similarity Score:
44.12%
Best Match:
CHEMBL1222035
FABP5_HUMAN
Docking Scores:
-6.12
-4.52
-4.52
Similarity Score:
53.49%
Best Match:
CHEMBL247298
FABP5_HUMAN
Docking Scores:
-5.54
-4.62
-4.54
Similarity Score:
38.20%
Best Match:
CHEMBL247298
FABP5_HUMAN
Docking Scores:
-8.20
-6.61
-6.49
Similarity Score:
29.23%
Best Match:
CHEMBL3941588
FABP5_HUMAN
Docking Scores:
-7.52
-5.26
-5.08
Similarity Score:
15.34%
Best Match:
CHEMBL3941588
FABP5_HUMAN
Docking Scores:
-6.59
-4.81
-4.83
Similarity Score:
27.04%
Best Match:
CHEMBL3941588
FYN_HUMAN
Docking Scores:
-7.60
Similarity Score:
29.36%
Best Match:
CHEMBL407135
GLRA3_HUMAN
Docking Scores:
-6.77
-6.95
-6.81
Similarity Score:
10.96%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-5.72
-5.78
-5.85
Similarity Score:
11.96%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-8.10
-8.73
-9.00
Similarity Score:
26.42%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-9.30
Similarity Score:
26.42%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-7.95
-8.02
-7.51
Similarity Score:
15.93%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-8.13
Similarity Score:
15.93%
Best Match:
CHEMBL4070615
GLRA3_HUMAN
Docking Scores:
-7.80
-7.36
-7.51
Similarity Score:
16.52%
Best Match:
CHEMBL4070615
GRM5_HUMAN
Docking Scores:
-6.61
-7.52
-7.37
Similarity Score:
51.65%
Best Match:
CHEMBL1682821
GRM5_HUMAN
Docking Scores:
-6.69
-6.64
-6.57
Similarity Score:
33.94%
Best Match:
CHEMBL381764
GRM5_HUMAN
Docking Scores:
-9.39
-5.81
-7.02
Similarity Score:
34.63%
Best Match:
CHEMBL1682833
GRM5_HUMAN
Docking Scores:
-3.49
-1.70
-3.17
Similarity Score:
28.91%
Best Match:
CHEMBL3087513
GRM5_HUMAN
Docking Scores:
-7.73
-6.74
-5.99
Similarity Score:
50.00%
Best Match:
CHEMBL2338576
HPGDS_HUMAN
Docking Scores:
-6.04
-6.12
-7.11
Similarity Score:
33.33%
Best Match:
CHEMBL2035654
HPGDS_HUMAN
Docking Scores:
-5.56
-6.08
-6.46
Similarity Score:
30.77%
Best Match:
CHEMBL2035654
HPGDS_HUMAN
Docking Scores:
-8.84
-8.80
-9.25
Similarity Score:
27.18%
Best Match:
CHEMBL3934642
HPGDS_HUMAN
Docking Scores:
-6.34
-5.35
-5.43
Similarity Score:
20.69%
Best Match:
CHEMBL3698278
HPGDS_HUMAN
Docking Scores:
-7.01
-5.36
-5.45
Similarity Score:
26.39%
Best Match:
CHEMBL3650224
HRH1_HUMAN
Docking Scores:
-10.76
Similarity Score:
35.78%
Best Match:
CHEMBL1077908
HRH1_HUMAN
Docking Scores:
-5.66
Similarity Score:
36.54%
Best Match:
CHEMBL1201203
HYES_HUMAN
Docking Scores:
-6.41
-6.70
-6.36
Similarity Score:
47.92%
Best Match:
CHEMBL244407
HYES_HUMAN
Docking Scores:
-6.19
-5.95
-6.21
Similarity Score:
47.83%
Best Match:
CHEMBL477046
HYES_HUMAN
Docking Scores:
-10.43
-9.66
-9.50
Similarity Score:
39.31%
Best Match:
CHEMBL2392745
HYES_HUMAN
Docking Scores:
-7.00
-6.97
-7.15
Similarity Score:
38.00%
Best Match:
CHEMBL561665
HYES_HUMAN
Docking Scores:
-7.51
-7.09
-6.06
Similarity Score:
53.19%
Best Match:
CHEMBL1933676
IKKB_HUMAN
Docking Scores:
-6.91
Similarity Score:
33.95%
Best Match:
CHEMBL1672879
MDR1_HUMAN
Docking Scores:
-5.43
-5.79
Similarity Score:
57.41%
Best Match:
CHEMBL278172
MDR1_HUMAN
Docking Scores:
-9.81
-8.69
Similarity Score:
34.34%
Best Match:
CHEMBL595995
MDR1_HUMAN
Docking Scores:
-6.35
-6.36
Similarity Score:
35.79%
Best Match:
CHEMBL1201219
MDR1_HUMAN
Docking Scores:
-6.21
-6.32
Similarity Score:
48.31%
Best Match:
CHEMBL2398176
MIF_HUMAN
Docking Scores:
-5.01
-6.21
-5.15
Similarity Score:
32.94%
Best Match:
CHEMBL224086
MIF_HUMAN
Docking Scores:
-6.22
-6.19
-5.57
Similarity Score:
36.84%
Best Match:
CHEMBL224086
MIF_HUMAN
Docking Scores:
-7.54
-8.00
-6.92
Similarity Score:
28.14%
Best Match:
CHEMBL3799453
MIF_HUMAN
Docking Scores:
-5.34
-5.71
-4.97
Similarity Score:
19.19%
Best Match:
CHEMBL554271
MIF_HUMAN
Docking Scores:
-5.42
-5.96
-5.78
Similarity Score:
29.11%
Best Match:
CHEMBL554271
MK01_HUMAN
Docking Scores:
-5.92
-5.73
-6.23
Similarity Score:
33.33%
Best Match:
CHEMBL2004872
MK01_HUMAN
Docking Scores:
-5.52
-5.71
-5.93
Similarity Score:
37.65%
Best Match:
CHEMBL24944
MK01_HUMAN
Docking Scores:
-8.32
-7.71
-7.58
Similarity Score:
39.87%
Best Match:
CHEMBL3590110
MK01_HUMAN
Docking Scores:
-6.56
-6.72
-6.43
Similarity Score:
23.03%
Best Match:
CHEMBL4106550
MK01_HUMAN
Docking Scores:
-5.46
-6.07
-5.58
Similarity Score:
35.25%
Best Match:
CHEMBL3752989
MK03_HUMAN
Docking Scores:
-6.05
-6.28
-6.48
Similarity Score:
31.45%
Best Match:
CHEMBL3797548
MK03_HUMAN
Docking Scores:
-5.62
-5.79
-5.95
Similarity Score:
30.77%
Best Match:
CHEMBL3798109
MK03_HUMAN
Docking Scores:
-9.36
-8.98
-8.81
Similarity Score:
33.13%
Best Match:
CHEMBL3798109
MK03_HUMAN
Docking Scores:
-6.42
-7.61
-6.62
Similarity Score:
19.82%
Best Match:
CHEMBL554497
MK03_HUMAN
Docking Scores:
-6.83
-7.65
-7.18
Similarity Score:
32.80%
Best Match:
CHEMBL3113587
MTOR_HUMAN
Docking Scores:
-6.33
-6.36
-6.18
Similarity Score:
28.80%
Best Match:
CHEMBL1241300
MTOR_HUMAN
Docking Scores:
-5.46
-5.55
-5.61
Similarity Score:
31.36%
Best Match:
CHEMBL1667869
MTOR_HUMAN
Docking Scores:
-9.06
-9.63
-9.04
Similarity Score:
45.96%
Best Match:
CHEMBL3594042
MTOR_HUMAN
Docking Scores:
-7.66
-7.55
-7.71
Similarity Score:
30.28%
Best Match:
CHEMBL3972399
MTOR_HUMAN
Docking Scores:
-7.43
-8.16
-7.40
Similarity Score:
31.28%
Best Match:
CHEMBL4100500
NEP_HUMAN
Docking Scores:
-6.69
-6.58
-6.88
Similarity Score:
29.69%
Best Match:
CHEMBL254493
NEP_HUMAN
Docking Scores:
-6.03
-6.39
-6.14
Similarity Score:
27.36%
Best Match:
CHEMBL273672
NEP_HUMAN
Docking Scores:
-8.53
-8.71
-9.19
Similarity Score:
22.82%
Best Match:
CHEMBL92949
NEP_HUMAN
Docking Scores:
-6.26
-6.23
-6.12
Similarity Score:
36.89%
Best Match:
CHEMBL3298941
NEP_HUMAN
Docking Scores:
-5.94
-7.39
-6.96
Similarity Score:
47.87%
Best Match:
CHEMBL378050
NK1R_HUMAN
Docking Scores:
-6.09
-6.16
-6.29
Similarity Score:
30.43%
Best Match:
CHEMBL93909
NK1R_HUMAN
Docking Scores:
-5.53
-5.74
-5.35
Similarity Score:
28.46%
Best Match:
CHEMBL424301
NK1R_HUMAN
Docking Scores:
-8.87
-8.55
-8.50
Similarity Score:
34.72%
Best Match:
CHEMBL453314
NK1R_HUMAN
Docking Scores:
-7.35
-7.29
-6.97
Similarity Score:
34.67%
Best Match:
CHEMBL119990
NK1R_HUMAN
Docking Scores:
-7.09
-6.95
-6.75
Similarity Score:
59.14%
Best Match:
CHEMBL1817821
NMDE1_HUMAN
Docking Scores:
-7.35
-6.92
-7.27
Similarity Score:
16.67%
Best Match:
CHEMBL2333945
NMDE1_HUMAN
Docking Scores:
-6.58
-6.30
-6.53
Similarity Score:
16.00%
Best Match:
CHEMBL2333945
NMDE1_HUMAN
Docking Scores:
-9.76
-10.68
-10.46
Similarity Score:
27.59%
Best Match:
CHEMBL2333945
NMDE1_HUMAN
Docking Scores:
-5.93
-5.98
-6.09
Similarity Score:
13.39%
Best Match:
CHEMBL284237
NMDE1_HUMAN
Docking Scores:
-8.37
-8.56
-8.33
Similarity Score:
32.41%
Best Match:
CHEMBL284237
NMDE2_HUMAN
Docking Scores:
-6.83
-6.61
-7.18
Similarity Score:
32.14%
Best Match:
CHEMBL161421
NMDE2_HUMAN
Docking Scores:
-6.17
-5.78
-6.35
Similarity Score:
31.73%
Best Match:
CHEMBL2013202
NMDE2_HUMAN
Docking Scores:
-9.39
-9.61
-9.43
Similarity Score:
26.01%
Best Match:
CHEMBL218017
NMDE2_HUMAN
Docking Scores:
-7.00
-7.81
-6.17
Similarity Score:
32.11%
Best Match:
CHEMBL147355
NMDE2_HUMAN
Docking Scores:
-7.14
-7.55
-6.65
Similarity Score:
48.28%
Best Match:
CHEMBL3357785
NMDZ1_HUMAN
Docking Scores:
-7.32
-6.93
-7.27
Similarity Score:
22.47%
Best Match:
CHEMBL162577
NMDZ1_HUMAN
Docking Scores:
-6.53
-6.43
-6.53
Similarity Score:
26.36%
Best Match:
CHEMBL163916
NMDZ1_HUMAN
Docking Scores:
-10.22
-10.76
-10.46
Similarity Score:
37.57%
Best Match:
CHEMBL164322
NMDZ1_HUMAN
Docking Scores:
-6.07
-6.63
-6.09
Similarity Score:
18.69%
Best Match:
CHEMBL399075
NMDZ1_HUMAN
Docking Scores:
-8.30
-8.54
-8.33
Similarity Score:
30.88%
Best Match:
CHEMBL325825
NOS1_HUMAN
Docking Scores:
-6.64
-6.86
-6.31
Similarity Score:
33.03%
Best Match:
CHEMBL4060083
NOS1_HUMAN
Docking Scores:
-7.56
-7.24
-6.64
Similarity Score:
39.68%
Best Match:
CHEMBL542431
NOS1_HUMAN
Docking Scores:
-9.75
-9.90
-9.04
Similarity Score:
29.11%
Best Match:
CHEMBL4086610
NOS1_HUMAN
Docking Scores:
-7.64
-7.44
-6.89
Similarity Score:
29.69%
Best Match:
CHEMBL1270460
NOS1_HUMAN
Docking Scores:
-6.29
-6.52
-7.21
Similarity Score:
44.21%
Best Match:
CHEMBL258348
NOS2_HUMAN
Docking Scores:
-5.95
-5.83
-6.25
Similarity Score:
35.92%
Best Match:
CHEMBL1762473
NOS2_HUMAN
Docking Scores:
-7.28
-5.92
-6.56
Similarity Score:
29.70%
Best Match:
CHEMBL1762473
NOS2_HUMAN
Docking Scores:
-8.04
-9.86
-1.95
Similarity Score:
30.80%
Best Match:
CHEMBL223838
NOS2_HUMAN
Docking Scores:
-6.09
-6.62
-6.94
Similarity Score:
40.00%
Best Match:
CHEMBL114551
NOS2_HUMAN
Docking Scores:
-5.56
-6.65
-6.78
Similarity Score:
44.21%
Best Match:
CHEMBL258348
NTRK1_HUMAN
Docking Scores:
-6.38
-6.45
-6.31
Similarity Score:
32.00%
Best Match:
CHEMBL2004025
NTRK1_HUMAN
Docking Scores:
-5.86
-5.77
-5.62
Similarity Score:
35.65%
Best Match:
CHEMBL2004025
NTRK1_HUMAN
Docking Scores:
-8.33
-9.32
-8.51
Similarity Score:
43.48%
Best Match:
CHEMBL2152285
NTRK1_HUMAN
Docking Scores:
-6.91
-7.05
-7.11
Similarity Score:
24.07%
Best Match:
CHEMBL1997617
NTRK1_HUMAN
Docking Scores:
-7.19
-7.14
-7.04
Similarity Score:
37.07%
Best Match:
CHEMBL1982413
OPRD_HUMAN
Docking Scores:
-5.82
-4.82
-5.15
Similarity Score:
34.75%
Best Match:
CHEMBL149074
OPRD_HUMAN
Docking Scores:
-5.50
-4.67
-5.17
Similarity Score:
36.36%
Best Match:
CHEMBL416930
OPRD_HUMAN
Docking Scores:
-7.42
-6.97
-7.42
Similarity Score:
29.41%
Best Match:
CHEMBL191987
OPRD_HUMAN
Docking Scores:
-6.36
-5.97
-5.91
Similarity Score:
38.95%
Best Match:
CHEMBL300662
OPRD_HUMAN
Docking Scores:
-6.90
-5.99
-6.72
Similarity Score:
54.74%
Best Match:
CHEMBL4062974
OPRK_HUMAN
Docking Scores:
-5.96
-6.23
-6.36
Similarity Score:
37.36%
Best Match:
CHEMBL942
OPRK_HUMAN
Docking Scores:
-5.75
-5.72
-6.51
Similarity Score:
36.56%
Best Match:
CHEMBL283552
OPRK_HUMAN
Docking Scores:
-8.85
-8.92
-9.45
Similarity Score:
33.74%
Best Match:
CHEMBL1713635
OPRK_HUMAN
Docking Scores:
-8.28
-8.04
-6.88
Similarity Score:
38.95%
Best Match:
CHEMBL300662
OPRK_HUMAN
Docking Scores:
-7.17
-7.64
-7.91
Similarity Score:
66.67%
Best Match:
CHEMBL512414
OPRM_MOUSE
Docking Scores:
-4.90
-5.24
Similarity Score:
36.56%
Best Match:
CHEMBL283552
OPRM_MOUSE
Docking Scores:
-8.75
-9.00
Similarity Score:
24.27%
Best Match:
CHEMBL605510
OPRM_MOUSE
Docking Scores:
-7.06
-6.82
Similarity Score:
33.05%
Best Match:
CHEMBL440765
OPRM_MOUSE
Docking Scores:
-7.35
-6.82
Similarity Score:
48.15%
Best Match:
CHEMBL2017149
OPRX_HUMAN
Docking Scores:
-5.82
-5.74
-5.84
Similarity Score:
35.00%
Best Match:
CHEMBL201805
OPRX_HUMAN
Docking Scores:
-5.36
-5.64
-5.52
Similarity Score:
32.17%
Best Match:
CHEMBL422641
OPRX_HUMAN
Docking Scores:
-8.19
-8.33
-9.28
Similarity Score:
27.42%
Best Match:
CHEMBL140580
OPRX_HUMAN
Docking Scores:
-6.50
-6.38
-6.19
Similarity Score:
37.93%
Best Match:
CHEMBL357076
OPRX_HUMAN
Docking Scores:
-6.32
-6.25
-6.64
Similarity Score:
66.67%
Best Match:
CHEMBL512414
P2RX3_HUMAN
Docking Scores:
-5.33
-4.52
-4.69
Similarity Score:
28.57%
Best Match:
CHEMBL3919713
P2RX3_HUMAN
Docking Scores:
-4.82
-4.87
-5.00
Similarity Score:
28.45%
Best Match:
CHEMBL3926652
P2RX3_HUMAN
Docking Scores:
-6.82
-6.42
-6.86
Similarity Score:
40.21%
Best Match:
CHEMBL2376118
P2RX3_HUMAN
Docking Scores:
-4.69
-4.76
-4.93
Similarity Score:
24.48%
Best Match:
CHEMBL3679748
P2RX3_HUMAN
Docking Scores:
-4.83
-4.75
-4.80
Similarity Score:
38.78%
Best Match:
CHEMBL3679792
P2Y12_HUMAN
Docking Scores:
-6.87
-6.37
-6.94
Similarity Score:
33.64%
Best Match:
CHEMBL327374
P2Y12_HUMAN
Docking Scores:
-6.08
-6.29
-6.21
Similarity Score:
31.37%
Best Match:
CHEMBL327374
P2Y12_HUMAN
Docking Scores:
-9.70
-8.38
-9.64
Similarity Score:
36.89%
Best Match:
CHEMBL2402273
P2Y12_HUMAN
Docking Scores:
-6.60
-3.62
-5.17
Similarity Score:
26.72%
Best Match:
CHEMBL509456
P2Y12_HUMAN
Docking Scores:
-6.75
-7.12
-7.89
Similarity Score:
37.69%
Best Match:
CHEMBL88799
PAR1_HUMAN
Docking Scores:
-7.06
Similarity Score:
32.26%
Best Match:
CHEMBL80672
PDE4B_HUMAN
Docking Scores:
-6.36
-7.14
-7.15
Similarity Score:
32.69%
Best Match:
CHEMBL2172710
PDE4B_HUMAN
Docking Scores:
-6.08
-6.33
-6.28
Similarity Score:
32.67%
Best Match:
CHEMBL3315270
PDE4B_HUMAN
Docking Scores:
-9.73
-9.54
-8.96
Similarity Score:
40.94%
Best Match:
CHEMBL576479
PDE4B_HUMAN
Docking Scores:
-7.08
-7.06
-7.10
Similarity Score:
25.36%
Best Match:
CHEMBL35486
PDE4B_HUMAN
Docking Scores:
-6.80
-6.55
-7.23
Similarity Score:
36.22%
Best Match:
CHEMBL3315258
PDE5A_HUMAN
Docking Scores:
-6.61
-6.38
-6.44
Similarity Score:
40.57%
Best Match:
CHEMBL363889
PDE5A_HUMAN
Docking Scores:
-6.33
-6.03
-5.92
Similarity Score:
32.73%
Best Match:
CHEMBL116818
PDE5A_HUMAN
Docking Scores:
-9.56
-10.11
-9.91
Similarity Score:
33.19%
Best Match:
CHEMBL79579
PDE5A_HUMAN
Docking Scores:
-6.66
-8.36
-6.64
Similarity Score:
24.52%
Best Match:
CHEMBL8132
PDE5A_HUMAN
Docking Scores:
-6.58
-7.58
-7.00
Similarity Score:
33.09%
Best Match:
CHEMBL190423
PERM_HUMAN
Docking Scores:
-6.04
-7.00
-5.98
Similarity Score:
38.24%
Best Match:
CHEMBL309339
PERM_HUMAN
Docking Scores:
-6.59
-6.65
-6.17
Similarity Score:
49.25%
Best Match:
CHEMBL686
PERM_HUMAN
Docking Scores:
-8.51
-8.92
-8.58
Similarity Score:
28.12%
Best Match:
CHEMBL3741401
PERM_HUMAN
Docking Scores:
-6.63
-6.57
-6.62
Similarity Score:
31.50%
Best Match:
CHEMBL490
PERM_HUMAN
Docking Scores:
-6.62
-7.15
-7.03
Similarity Score:
40.45%
Best Match:
CHEMBL3892909
PGH1_SHEEP
Docking Scores:
-6.16
-6.65
-6.06
Similarity Score:
100.00%
Best Match:
CHEMBL25
PGH1_SHEEP
Docking Scores:
-6.05
-5.81
-6.43
Similarity Score:
51.56%
Best Match:
CHEMBL25
PGH1_SHEEP
Docking Scores:
-9.54
-9.57
-9.55
Similarity Score:
32.14%
Best Match:
CHEMBL298031
PGH1_SHEEP
Docking Scores:
-5.10
-6.10
-6.36
Similarity Score:
31.53%
Best Match:
CHEMBL1096320
PGH1_SHEEP
Docking Scores:
-5.69
-7.69
-7.90
Similarity Score:
39.76%
Best Match:
CHEMBL1945285
PGH2_HUMAN
Docking Scores:
-6.19
-6.20
-6.55
Similarity Score:
72.60%
Best Match:
CHEMBL1958348
PGH2_HUMAN
Docking Scores:
-6.31
-6.28
-5.98
Similarity Score:
49.25%
Best Match:
CHEMBL686
PGH2_HUMAN
Docking Scores:
-4.37
-7.37
-8.72
Similarity Score:
43.15%
Best Match:
CHEMBL405744
PGH2_HUMAN
Docking Scores:
-2.49
-4.75
-5.63
Similarity Score:
23.53%
Best Match:
CHEMBL432260
PGH2_HUMAN
Docking Scores:
-5.81
-5.99
-7.45
Similarity Score:
40.48%
Best Match:
CHEMBL441414
PPAP_HUMAN
Docking Scores:
-6.45
Similarity Score:
11.76%
Best Match:
CHEMBL507996
PPARG_HUMAN
Docking Scores:
-5.58
-6.46
-5.74
Similarity Score:
46.99%
Best Match:
CHEMBL207570
PPARG_HUMAN
Docking Scores:
-5.41
-5.51
-5.56
Similarity Score:
48.53%
Best Match:
CHEMBL2057864
PPARG_HUMAN
Docking Scores:
-8.86
-9.20
-8.38
Similarity Score:
50.28%
Best Match:
CHEMBL2331784
PPARG_HUMAN
Docking Scores:
-6.62
-6.61
-6.88
Similarity Score:
29.70%
Best Match:
CHEMBL377213
PPARG_HUMAN
Docking Scores:
-6.50
-6.39
-6.32
Similarity Score:
42.31%
Best Match:
CHEMBL3765141
PRGR_HUMAN
Docking Scores:
-6.28
-6.24
-6.04
Similarity Score:
32.46%
Best Match:
CHEMBL50849
PRGR_HUMAN
Docking Scores:
-6.11
-5.99
-5.87
Similarity Score:
34.67%
Best Match:
CHEMBL350283
PRGR_HUMAN
Docking Scores:
-5.93
-4.66
-7.63
Similarity Score:
43.54%
Best Match:
CHEMBL3961285
PRGR_HUMAN
Docking Scores:
-6.23
-6.15
-7.40
Similarity Score:
25.41%
Best Match:
CHEMBL3765823
PRGR_HUMAN
Docking Scores:
-7.62
-7.82
-7.32
Similarity Score:
45.61%
Best Match:
CHEMBL1163480
PTGES_HUMAN
Docking Scores:
-9.14
Similarity Score:
43.37%
Best Match:
CHEMBL3092270
PTGES_HUMAN
Docking Scores:
-5.29
Similarity Score:
31.86%
Best Match:
CHEMBL3919693
SC6A4_HUMAN
Docking Scores:
-6.16
-6.18
-6.35
Similarity Score:
41.03%
Best Match:
CHEMBL272002
SC6A4_HUMAN
Docking Scores:
-6.07
-5.99
-5.97
Similarity Score:
35.06%
Best Match:
CHEMBL204199
SC6A4_HUMAN
Docking Scores:
-9.64
-9.22
-9.97
Similarity Score:
35.15%
Best Match:
CHEMBL1836102
SC6A4_HUMAN
Docking Scores:
-7.55
-7.73
-7.29
Similarity Score:
40.62%
Best Match:
CHEMBL1172744
SC6A4_HUMAN
Docking Scores:
-7.37
-7.42
-7.56
Similarity Score:
63.10%
Best Match:
CHEMBL2407327
SCN9A_HUMAN
Docking Scores:
-9.11
Similarity Score:
48.35%
Best Match:
CHEMBL2324393
SCN9A_HUMAN
Docking Scores:
-5.30
Similarity Score:
28.35%
Best Match:
CHEMBL3632696
TLR4_HUMAN
Docking Scores:
-5.66
-6.08
-6.26
Similarity Score:
29.70%
Best Match:
CHEMBL1223752
TLR4_HUMAN
Docking Scores:
-5.50
-5.20
-5.92
Similarity Score:
28.10%
Best Match:
CHEMBL4071705
TLR4_HUMAN
Docking Scores:
-8.11
-8.69
-8.76
Similarity Score:
30.86%
Best Match:
CHEMBL3823499
TLR4_HUMAN
Docking Scores:
-6.60
-6.47
-6.80
Similarity Score:
26.74%
Best Match:
CHEMBL2386454
TLR4_HUMAN
Docking Scores:
-6.76
-6.47
-6.88
Similarity Score:
26.76%
Best Match:
CHEMBL2419455
TNFA_HUMAN
Docking Scores:
-7.92
Similarity Score:
32.78%
Best Match:
CHEMBL1465706
TNFA_HUMAN
Docking Scores:
-6.91
Similarity Score:
26.02%
Best Match:
CHEMBL3805615
TRPV1_RAT
Docking Scores:
-6.49
Similarity Score:
28.68%
Best Match:
CHEMBL101775
TRPV3_HUMAN
Docking Scores:
-5.23
-5.53
Similarity Score:
24.22%
Best Match:
CHEMBL3692228
TRPV3_HUMAN
Docking Scores:
-4.84
-5.09
Similarity Score:
21.95%
Best Match:
CHEMBL3692228
TRPV3_HUMAN
Docking Scores:
-7.51
-7.84
Similarity Score:
27.59%
Best Match:
CHEMBL3692265
TRPV3_HUMAN
Docking Scores:
-6.19
-6.21
Similarity Score:
21.82%
Best Match:
CHEMBL3664218
TRPV3_HUMAN
Docking Scores:
-6.85
-6.70
Similarity Score:
40.85%
Best Match:
CHEMBL3664218
TRXR1_HUMAN
Docking Scores:
-7.91
-10.21
-7.35
Similarity Score:
N/A
Best Match:
N/A
TRXR1_HUMAN
Docking Scores:
-7.30
-6.62
-5.93
Similarity Score:
N/A
Best Match:
N/A
TRY1_HUMAN
Docking Scores:
-4.97
Similarity Score:
32.50%
Best Match:
CHEMBL312647