Non anti-pain drug nv2 #224 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Hydrochlorothiazide
5HT1B_HUMAN

Docking Scores:
-7.37 -7.65 -7.11
Similarity Score:
37.96%
Best Match:
CHEMBL97596

L: Dolutegravir
5HT1B_HUMAN

Docking Scores:
-10.50 -10.90 -10.29
Similarity Score:
36.53%
Best Match:
CHEMBL225310

L: Metolazone
5HT1B_HUMAN

Docking Scores:
-9.04 -9.47 -9.31
Similarity Score:
37.77%
Best Match:
CHEMBL370852

L: Bendroflumethiazide
5HT1B_HUMAN

Docking Scores:
-9.49 -9.83 -9.52
Similarity Score:
33.67%
Best Match:
CHEMBL342323

L: Hydralazine
5HT1B_HUMAN

Docking Scores:
-6.96 -7.24 -6.77
Similarity Score:
29.41%
Best Match:
CHEMBL39

L: Hydrochlorothiazide
5HT2A_HUMAN

Docking Scores:
-7.68 -7.11
Similarity Score:
41.73%
Best Match:
CHEMBL3753681

L: Dolutegravir
5HT2A_HUMAN

Docking Scores:
-10.85 -10.38
Similarity Score:
38.84%
Best Match:
CHEMBL289061

L: Metolazone
5HT2A_HUMAN

Docking Scores:
-8.97 -9.41
Similarity Score:
56.05%
Best Match:
CHEMBL590482

L: Bendroflumethiazide
5HT2A_HUMAN

Docking Scores:
-10.34 -9.46
Similarity Score:
45.91%
Best Match:
CHEMBL495678

L: Hydralazine
5HT2A_HUMAN

Docking Scores:
-6.66 -6.60
Similarity Score:
35.53%
Best Match:
CHEMBL199385

L: Hydrochlorothiazide
5HT2B_HUMAN

Docking Scores:
-6.89 -7.30 -7.58
Similarity Score:
34.59%
Best Match:
CHEMBL333784

L: Dolutegravir
5HT2B_HUMAN

Docking Scores:
-11.32 -11.17 -11.47
Similarity Score:
38.40%
Best Match:
CHEMBL472415

L: Metolazone
5HT2B_HUMAN

Docking Scores:
-9.53 -9.50 -9.98
Similarity Score:
56.05%
Best Match:
CHEMBL590482

L: Bendroflumethiazide
5HT2B_HUMAN

Docking Scores:
-9.43 -9.86 -10.00
Similarity Score:
39.88%
Best Match:
CHEMBL493951

L: Hydralazine
5HT2B_HUMAN

Docking Scores:
-7.57 -7.37 -7.67
Similarity Score:
35.53%
Best Match:
CHEMBL199385

L: Hydrochlorothiazide
5HT2C_HUMAN

Docking Scores:
-6.88 -7.43
Similarity Score:
42.64%
Best Match:
CHEMBL1222293

L: Dolutegravir
5HT2C_HUMAN

Docking Scores:
-10.65 -11.01
Similarity Score:
46.80%
Best Match:
CHEMBL216280

L: Metolazone
5HT2C_HUMAN

Docking Scores:
-9.33 -8.70
Similarity Score:
58.97%
Best Match:
CHEMBL605402

L: Bendroflumethiazide
5HT2C_HUMAN

Docking Scores:
-9.62 -10.42
Similarity Score:
45.91%
Best Match:
CHEMBL495678

L: Hydralazine
5HT2C_HUMAN

Docking Scores:
-6.93 -7.12
Similarity Score:
35.53%
Best Match:
CHEMBL199385

L: Hydrochlorothiazide
AA1R_HUMAN

Docking Scores:
-6.27 -6.73 -7.06
Similarity Score:
23.91%
Best Match:
CHEMBL608980

L: Dolutegravir
AA1R_HUMAN

Docking Scores:
-9.81 -9.40 -9.13
Similarity Score:
38.40%
Best Match:
CHEMBL3765424

L: Metolazone
AA1R_HUMAN

Docking Scores:
-7.99 -8.35 -8.64
Similarity Score:
36.73%
Best Match:
CHEMBL608980

L: Bendroflumethiazide
AA1R_HUMAN

Docking Scores:
-9.23 -9.41 -9.19
Similarity Score:
36.06%
Best Match:
CHEMBL210585

L: Hydralazine
AA1R_HUMAN

Docking Scores:
-6.14 -6.56 -7.10
Similarity Score:
34.31%
Best Match:
CHEMBL320805

L: Hydrochlorothiazide
AA2AR_HUMAN

Docking Scores:
-6.53 -6.43 -7.08
Similarity Score:
29.44%
Best Match:
CHEMBL483487

L: Dolutegravir
AA2AR_HUMAN

Docking Scores:
-9.89 -9.70 -10.46
Similarity Score:
40.52%
Best Match:
CHEMBL196665

L: Metolazone
AA2AR_HUMAN

Docking Scores:
-7.88 -7.57 -9.77
Similarity Score:
36.73%
Best Match:
CHEMBL608980

L: Bendroflumethiazide
AA2AR_HUMAN

Docking Scores:
-8.46 -8.69 -9.76
Similarity Score:
36.06%
Best Match:
CHEMBL210585

L: Hydralazine
AA2AR_HUMAN

Docking Scores:
-6.28 -6.67 -7.05
Similarity Score:
34.31%
Best Match:
CHEMBL320805

L: Hydrochlorothiazide
ACES_HUMAN

Docking Scores:
-8.39 -8.40 -9.31
Similarity Score:
37.50%
Best Match:
CHEMBL573102

L: Dolutegravir
ACES_HUMAN

Docking Scores:
-10.96 -10.97 -8.41
Similarity Score:
40.17%
Best Match:
CHEMBL140106

L: Metolazone
ACES_HUMAN

Docking Scores:
-10.28 -9.49 -8.28
Similarity Score:
49.01%
Best Match:
CHEMBL141810

L: Bendroflumethiazide
ACES_HUMAN

Docking Scores:
-10.29 -11.12 -8.50
Similarity Score:
38.56%
Best Match:
CHEMBL575621

L: Hydralazine
ACES_HUMAN

Docking Scores:
-7.56 -7.35 -8.20
Similarity Score:
41.67%
Best Match:
CHEMBL1202884

L: Hydrochlorothiazide
ACE_HUMAN

Docking Scores:
-7.42 -7.19 -6.82
Similarity Score:
24.87%
Best Match:
CHEMBL514138

L: Dolutegravir
ACE_HUMAN

Docking Scores:
-10.54 -10.25 -9.04
Similarity Score:
30.86%
Best Match:
CHEMBL2435340

L: Metolazone
ACE_HUMAN

Docking Scores:
-8.65 -8.34 -8.09
Similarity Score:
33.52%
Best Match:
CHEMBL2435340

L: Bendroflumethiazide
ACE_HUMAN

Docking Scores:
-9.52 -9.83 -8.64
Similarity Score:
27.73%
Best Match:
CHEMBL514138

L: Hydralazine
ACE_HUMAN

Docking Scores:
-6.50 -6.65 -6.46
Similarity Score:
19.18%
Best Match:
CHEMBL3414811

L: Hydrochlorothiazide
ACHA9_HUMAN

Docking Scores:
-6.63
Similarity Score:
14.61%
Best Match:
CHEMBL386114

L: Dolutegravir
ACHA9_HUMAN

Docking Scores:
-8.20
Similarity Score:
26.35%
Best Match:
CHEMBL386114

L: Metolazone
ACHA9_HUMAN

Docking Scores:
-7.72
Similarity Score:
19.26%
Best Match:
CHEMBL386114

L: Bendroflumethiazide
ACHA9_HUMAN

Docking Scores:
-7.66
Similarity Score:
22.31%
Best Match:
CHEMBL386114

L: Hydralazine
ACHA9_HUMAN

Docking Scores:
-5.94
Similarity Score:
12.09%
Best Match:
CHEMBL386114

L: Hydrochlorothiazide
ACHB2_HUMAN

Docking Scores:
-5.17 -7.39 -7.13
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
ACHB2_HUMAN

Docking Scores:
-9.63 -4.90 -5.75
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
ACHB2_HUMAN

Docking Scores:
-5.97 -4.42 -4.88
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
ACHB2_HUMAN

Docking Scores:
-6.75 -7.16 -5.84
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
ACHB2_HUMAN

Docking Scores:
-6.39 -7.02 -7.20
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
ACM1_HUMAN

Docking Scores:
-8.69 -4.84
Similarity Score:
35.00%
Best Match:
CHEMBL2057767

L: Dolutegravir
ACM1_HUMAN

Docking Scores:
-8.63 2.61
Similarity Score:
39.79%
Best Match:
CHEMBL3608415

L: Metolazone
ACM1_HUMAN

Docking Scores:
-4.81 1.94
Similarity Score:
44.87%
Best Match:
CHEMBL3600977

L: Bendroflumethiazide
ACM1_HUMAN

Docking Scores:
-8.88 -2.10
Similarity Score:
34.90%
Best Match:
CHEMBL2057775

L: Hydralazine
ACM1_HUMAN

Docking Scores:
-7.12 -6.85
Similarity Score:
29.91%
Best Match:
CHEMBL3360955

L: Hydrochlorothiazide
ACM4_HUMAN

Docking Scores:
-8.43 -6.99
Similarity Score:
33.74%
Best Match:
CHEMBL4082397

L: Dolutegravir
ACM4_HUMAN

Docking Scores:
-8.98 -9.17
Similarity Score:
36.77%
Best Match:
CHEMBL107679

L: Metolazone
ACM4_HUMAN

Docking Scores:
-8.35 -8.56
Similarity Score:
39.15%
Best Match:
CHEMBL3633184

L: Bendroflumethiazide
ACM4_HUMAN

Docking Scores:
-7.76 -9.22
Similarity Score:
38.27%
Best Match:
CHEMBL4060443

L: Hydralazine
ACM4_HUMAN

Docking Scores:
-7.26 -7.11
Similarity Score:
25.49%
Best Match:
CHEMBL7568

L: Hydrochlorothiazide
ADRB2_HUMAN

Docking Scores:
-7.04 -7.49 -8.28
Similarity Score:
40.14%
Best Match:
CHEMBL1598434

L: Dolutegravir
ADRB2_HUMAN

Docking Scores:
-9.45 -9.56 -11.09
Similarity Score:
40.82%
Best Match:
CHEMBL235612

L: Metolazone
ADRB2_HUMAN

Docking Scores:
-7.55 -7.64 -9.84
Similarity Score:
51.85%
Best Match:
CHEMBL1490889

L: Bendroflumethiazide
ADRB2_HUMAN

Docking Scores:
-8.06 -9.30 -9.98
Similarity Score:
48.62%
Best Match:
CHEMBL347582

L: Hydralazine
ADRB2_HUMAN

Docking Scores:
-7.24 -7.72 -7.82
Similarity Score:
32.54%
Best Match:
CHEMBL1383120

L: Hydrochlorothiazide
AGTR2_HUMAN

Docking Scores:
-6.90 -6.76 -6.38
Similarity Score:
26.13%
Best Match:
CHEMBL194608

L: Dolutegravir
AGTR2_HUMAN

Docking Scores:
-9.48 -10.60 -9.85
Similarity Score:
34.63%
Best Match:
CHEMBL2435821

L: Metolazone
AGTR2_HUMAN

Docking Scores:
-8.78 -8.97 -8.04
Similarity Score:
34.69%
Best Match:
CHEMBL263452

L: Bendroflumethiazide
AGTR2_HUMAN

Docking Scores:
-9.66 -9.77 -9.38
Similarity Score:
33.87%
Best Match:
CHEMBL263714

L: Hydralazine
AGTR2_HUMAN

Docking Scores:
-6.39 -6.31 -6.08
Similarity Score:
14.37%
Best Match:
CHEMBL288705

L: Hydrochlorothiazide
ALDR_HUMAN

Docking Scores:
-6.87 -6.82 -7.00
Similarity Score:
32.69%
Best Match:
CHEMBL240719

L: Dolutegravir
ALDR_HUMAN

Docking Scores:
-11.22 -11.71 -11.24
Similarity Score:
42.69%
Best Match:
CHEMBL334830

L: Metolazone
ALDR_HUMAN

Docking Scores:
-8.12 -8.70 -7.74
Similarity Score:
45.95%
Best Match:
CHEMBL291854

L: Bendroflumethiazide
ALDR_HUMAN

Docking Scores:
-9.76 -9.53 -9.30
Similarity Score:
50.90%
Best Match:
CHEMBL240719

L: Hydralazine
ALDR_HUMAN

Docking Scores:
-7.98 -7.98 -7.62
Similarity Score:
27.84%
Best Match:
CHEMBL369911

L: Hydrochlorothiazide
AMPN_HUMAN

Docking Scores:
-7.24 -7.73 -7.35
Similarity Score:
21.19%
Best Match:
CHEMBL328470

L: Dolutegravir
AMPN_HUMAN

Docking Scores:
-10.19 -10.63 -10.03
Similarity Score:
35.92%
Best Match:
CHEMBL1077583

L: Metolazone
AMPN_HUMAN

Docking Scores:
-8.66 -8.42 -8.53
Similarity Score:
32.12%
Best Match:
CHEMBL2332526

L: Bendroflumethiazide
AMPN_HUMAN

Docking Scores:
-9.48 -9.77 -9.22
Similarity Score:
24.49%
Best Match:
CHEMBL1077591

L: Hydralazine
AMPN_HUMAN

Docking Scores:
-6.65 -7.46 -7.26
Similarity Score:
18.26%
Best Match:
CHEMBL328470

L: Hydrochlorothiazide
AOFA_HUMAN

Docking Scores:
-7.37 -7.79 -7.80
Similarity Score:
23.48%
Best Match:
CHEMBL828

L: Dolutegravir
AOFA_HUMAN

Docking Scores:
-11.14 -11.59 -12.90
Similarity Score:
37.40%
Best Match:
CHEMBL3407582

L: Metolazone
AOFA_HUMAN

Docking Scores:
-9.88 -10.50 -9.94
Similarity Score:
38.32%
Best Match:
CHEMBL3319257

L: Bendroflumethiazide
AOFA_HUMAN

Docking Scores:
-10.58 -9.86 -9.59
Similarity Score:
25.29%
Best Match:
CHEMBL3416434

L: Hydralazine
AOFA_HUMAN

Docking Scores:
-7.67 -7.28 -8.02
Similarity Score:
30.95%
Best Match:
CHEMBL258420

L: Hydrochlorothiazide
AOFB_HUMAN

Docking Scores:
-7.98 -8.02 -8.24
Similarity Score:
26.21%
Best Match:
CHEMBL3319259

L: Dolutegravir
AOFB_HUMAN

Docking Scores:
-10.78 -11.34 -10.91
Similarity Score:
37.40%
Best Match:
CHEMBL3407582

L: Metolazone
AOFB_HUMAN

Docking Scores:
-10.24 -10.59 -10.71
Similarity Score:
40.13%
Best Match:
CHEMBL3319251

L: Bendroflumethiazide
AOFB_HUMAN

Docking Scores:
-9.95 -10.36 -9.42
Similarity Score:
27.78%
Best Match:
CHEMBL3319243

L: Hydralazine
AOFB_HUMAN

Docking Scores:
-7.41 -7.47 -7.20
Similarity Score:
36.67%
Best Match:
CHEMBL3319272

L: Hydrochlorothiazide
BACE1_HUMAN

Docking Scores:
-5.98 -6.41 -6.93
Similarity Score:
23.97%
Best Match:
CHEMBL3354257

L: Dolutegravir
BACE1_HUMAN

Docking Scores:
-8.87 -8.61 -9.95
Similarity Score:
42.71%
Best Match:
CHEMBL253865

L: Metolazone
BACE1_HUMAN

Docking Scores:
-7.33 -7.58 -8.94
Similarity Score:
48.75%
Best Match:
CHEMBL190644

L: Bendroflumethiazide
BACE1_HUMAN

Docking Scores:
-7.75 -7.98 -9.02
Similarity Score:
33.47%
Best Match:
CHEMBL1097346

L: Hydralazine
BACE1_HUMAN

Docking Scores:
-5.61 -6.44 -7.03
Similarity Score:
31.34%
Best Match:
CHEMBL2059101

L: Hydrochlorothiazide
CAH2_HUMAN

Docking Scores:
-7.46 -7.22 -7.26
Similarity Score:
100.00%
Best Match:
CHEMBL435

L: Dolutegravir
CAH2_HUMAN

Docking Scores:
-8.74 -9.33 -9.48
Similarity Score:
41.16%
Best Match:
CHEMBL217232

L: Metolazone
CAH2_HUMAN

Docking Scores:
-8.29 -8.07 -8.05
Similarity Score:
69.40%
Best Match:
CHEMBL295343

L: Bendroflumethiazide
CAH2_HUMAN

Docking Scores:
-8.79 -8.57 -8.40
Similarity Score:
58.39%
Best Match:
CHEMBL1054

L: Hydralazine
CAH2_HUMAN

Docking Scores:
-6.72 -6.62 -6.44
Similarity Score:
31.25%
Best Match:
CHEMBL2336906

L: Hydrochlorothiazide
CASP1_HUMAN

Docking Scores:
-5.56 -5.91 -6.21
Similarity Score:
27.45%
Best Match:
CHEMBL3133256

L: Dolutegravir
CASP1_HUMAN

Docking Scores:
-8.18 -8.48 -7.91
Similarity Score:
43.18%
Best Match:
CHEMBL468641

L: Metolazone
CASP1_HUMAN

Docking Scores:
-6.44 -7.52 -6.95
Similarity Score:
47.06%
Best Match:
CHEMBL3133256

L: Bendroflumethiazide
CASP1_HUMAN

Docking Scores:
-7.31 -7.82 -7.68
Similarity Score:
38.64%
Best Match:
CHEMBL2381345

L: Hydralazine
CASP1_HUMAN

Docking Scores:
-5.92 -6.75 -5.72
Similarity Score:
19.40%
Best Match:
CHEMBL1221744

L: Hydrochlorothiazide
CDK5_HUMAN

Docking Scores:
-7.37 -7.67 -7.39
Similarity Score:
34.59%
Best Match:
CHEMBL1967612

L: Dolutegravir
CDK5_HUMAN

Docking Scores:
-9.09 -9.03 -9.57
Similarity Score:
38.24%
Best Match:
CHEMBL1982506

L: Metolazone
CDK5_HUMAN

Docking Scores:
-8.20 -8.23 -6.72
Similarity Score:
42.41%
Best Match:
CHEMBL1981782

L: Bendroflumethiazide
CDK5_HUMAN

Docking Scores:
-9.61 -9.56 -8.54
Similarity Score:
33.00%
Best Match:
CHEMBL1967544

L: Hydralazine
CDK5_HUMAN

Docking Scores:
-6.92 -7.01 -7.89
Similarity Score:
50.00%
Best Match:
CHEMBL1971519

L: Hydrochlorothiazide
CHLE_HUMAN

Docking Scores:
-7.94 -8.25 -8.21
Similarity Score:
28.78%
Best Match:
CHEMBL601282

L: Dolutegravir
CHLE_HUMAN

Docking Scores:
-10.04 -9.67 -10.32
Similarity Score:
35.54%
Best Match:
CHEMBL3628054

L: Metolazone
CHLE_HUMAN

Docking Scores:
-8.95 -8.98 -9.20
Similarity Score:
37.65%
Best Match:
CHEMBL592673

L: Bendroflumethiazide
CHLE_HUMAN

Docking Scores:
-9.66 -9.92 -10.07
Similarity Score:
30.90%
Best Match:
CHEMBL602314

L: Hydralazine
CHLE_HUMAN

Docking Scores:
-7.14 -7.03 -7.14
Similarity Score:
41.67%
Best Match:
CHEMBL1202884

L: Hydrochlorothiazide
CNR1_HUMAN

Docking Scores:
-5.90 -7.75 -7.94
Similarity Score:
44.80%
Best Match:
CHEMBL2336561

L: Dolutegravir
CNR1_HUMAN

Docking Scores:
-9.54 -10.34 -10.22
Similarity Score:
49.21%
Best Match:
CHEMBL2163946

L: Metolazone
CNR1_HUMAN

Docking Scores:
-7.65 -8.79 -9.63
Similarity Score:
55.29%
Best Match:
CHEMBL246302

L: Bendroflumethiazide
CNR1_HUMAN

Docking Scores:
-7.69 -10.32 -8.76
Similarity Score:
57.62%
Best Match:
CHEMBL3975498

L: Hydralazine
CNR1_HUMAN

Docking Scores:
-6.33 -6.49 -7.21
Similarity Score:
33.33%
Best Match:
CHEMBL472897

L: Hydrochlorothiazide
CNR2_HUMAN

Docking Scores:
-7.92 -7.45
Similarity Score:
44.80%
Best Match:
CHEMBL2336561

L: Dolutegravir
CNR2_HUMAN

Docking Scores:
-10.28 -11.12
Similarity Score:
49.38%
Best Match:
CHEMBL3409320

L: Metolazone
CNR2_HUMAN

Docking Scores:
-9.45 -9.56
Similarity Score:
55.90%
Best Match:
CHEMBL253462

L: Bendroflumethiazide
CNR2_HUMAN

Docking Scores:
-10.13 -10.36
Similarity Score:
58.39%
Best Match:
CHEMBL3920211

L: Hydralazine
CNR2_HUMAN

Docking Scores:
-6.91 -6.94
Similarity Score:
32.99%
Best Match:
CHEMBL3421694

L: Hydrochlorothiazide
COLI_HUMAN

Docking Scores:
-8.08 -7.31 -6.75
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
COLI_HUMAN

Docking Scores:
-10.00 -9.98 -9.09
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
COLI_HUMAN

Docking Scores:
-8.58 -8.71 -7.60
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
COLI_HUMAN

Docking Scores:
-9.14 -8.81 -8.39
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
COLI_HUMAN

Docking Scores:
-7.22 -7.17 -6.43
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
COMT_HUMAN

Docking Scores:
-4.73 -5.14 -4.60
Similarity Score:
20.00%
Best Match:
CHEMBL3798524

L: Dolutegravir
COMT_HUMAN

Docking Scores:
-7.20 -7.12 -7.24
Similarity Score:
31.80%
Best Match:
CHEMBL3799623

L: Metolazone
COMT_HUMAN

Docking Scores:
-7.60 -6.79 -7.24
Similarity Score:
24.42%
Best Match:
CHEMBL3818719

L: Bendroflumethiazide
COMT_HUMAN

Docking Scores:
-6.80 -6.32 -6.77
Similarity Score:
21.00%
Best Match:
CHEMBL3425737

L: Hydralazine
COMT_HUMAN

Docking Scores:
-6.43 -5.88 -6.56
Similarity Score:
33.70%
Best Match:
CHEMBL3797305

L: Hydrochlorothiazide
CRP_HUMAN

Docking Scores:
-5.23 -5.64
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
CRP_HUMAN

Docking Scores:
-7.69 -7.15
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
CRP_HUMAN

Docking Scores:
-6.43 -6.49
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
CRP_HUMAN

Docking Scores:
-6.64 -6.68
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
CRP_HUMAN

Docking Scores:
-5.33 -6.00
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
CXCR1_HUMAN

Docking Scores:
-6.67
Similarity Score:
38.56%
Best Match:
CHEMBL218387

L: Dolutegravir
CXCR1_HUMAN

Docking Scores:
-0.72
Similarity Score:
36.43%
Best Match:
CHEMBL3609013

L: Metolazone
CXCR1_HUMAN

Docking Scores:
-2.45
Similarity Score:
37.24%
Best Match:
CHEMBL3609013

L: Bendroflumethiazide
CXCR1_HUMAN

Docking Scores:
-4.69
Similarity Score:
34.84%
Best Match:
CHEMBL221481

L: Hydralazine
CXCR1_HUMAN

Docking Scores:
-7.72
Similarity Score:
26.51%
Best Match:
CHEMBL184637

L: Hydrochlorothiazide
CXCR4_HUMAN

Docking Scores:
-7.08 -6.47 -6.47
Similarity Score:
27.88%
Best Match:
CHEMBL3627862

L: Dolutegravir
CXCR4_HUMAN

Docking Scores:
-10.79 -8.42 -9.77
Similarity Score:
44.13%
Best Match:
CHEMBL3893083

L: Metolazone
CXCR4_HUMAN

Docking Scores:
-8.18 -7.13 -7.69
Similarity Score:
33.99%
Best Match:
CHEMBL3908835

L: Bendroflumethiazide
CXCR4_HUMAN

Docking Scores:
-9.75 -7.90 -8.14
Similarity Score:
31.44%
Best Match:
CHEMBL3627858

L: Hydralazine
CXCR4_HUMAN

Docking Scores:
-7.26 -6.23 -6.81
Similarity Score:
25.61%
Best Match:
CHEMBL237830

L: Hydrochlorothiazide
DRD2_HUMAN

Docking Scores:
-6.78
Similarity Score:
38.57%
Best Match:
CHEMBL195247

L: Dolutegravir
DRD2_HUMAN

Docking Scores:
-10.54
Similarity Score:
40.94%
Best Match:
CHEMBL4093477

L: Metolazone
DRD2_HUMAN

Docking Scores:
-8.00
Similarity Score:
44.52%
Best Match:
CHEMBL560177

L: Bendroflumethiazide
DRD2_HUMAN

Docking Scores:
-9.51
Similarity Score:
45.09%
Best Match:
CHEMBL4081383

L: Hydralazine
DRD2_HUMAN

Docking Scores:
-6.49
Similarity Score:
35.96%
Best Match:
CHEMBL3221299

L: Hydrochlorothiazide
DRD3_HUMAN

Docking Scores:
-7.40
Similarity Score:
38.57%
Best Match:
CHEMBL195247

L: Dolutegravir
DRD3_HUMAN

Docking Scores:
-10.44
Similarity Score:
48.29%
Best Match:
CHEMBL495573

L: Metolazone
DRD3_HUMAN

Docking Scores:
-8.16
Similarity Score:
44.52%
Best Match:
CHEMBL560177

L: Bendroflumethiazide
DRD3_HUMAN

Docking Scores:
-9.99
Similarity Score:
41.75%
Best Match:
CHEMBL238916

L: Hydralazine
DRD3_HUMAN

Docking Scores:
-6.85
Similarity Score:
30.39%
Best Match:
CHEMBL1223748

L: Hydrochlorothiazide
DRD4_HUMAN

Docking Scores:
-8.06 -8.13
Similarity Score:
38.57%
Best Match:
CHEMBL195247

L: Dolutegravir
DRD4_HUMAN

Docking Scores:
-11.13 -11.15
Similarity Score:
39.60%
Best Match:
CHEMBL1627311

L: Metolazone
DRD4_HUMAN

Docking Scores:
-9.29 -9.25
Similarity Score:
51.43%
Best Match:
CHEMBL106917

L: Bendroflumethiazide
DRD4_HUMAN

Docking Scores:
-10.07 -10.41
Similarity Score:
38.46%
Best Match:
CHEMBL106917

L: Hydralazine
DRD4_HUMAN

Docking Scores:
-7.51 -7.67
Similarity Score:
30.39%
Best Match:
CHEMBL273860

L: Hydrochlorothiazide
EDN1_HUMAN

Docking Scores:
-6.57
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
EDN1_HUMAN

Docking Scores:
-9.99
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
EDN1_HUMAN

Docking Scores:
-7.35
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
EDN1_HUMAN

Docking Scores:
-9.28
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
EDN1_HUMAN

Docking Scores:
-6.94
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
ESR1_HUMAN

Docking Scores:
-7.40 -7.38 -7.24
Similarity Score:
39.85%
Best Match:
CHEMBL264655

L: Dolutegravir
ESR1_HUMAN

Docking Scores:
-8.72 -10.00 -9.04
Similarity Score:
35.42%
Best Match:
CHEMBL3925390

L: Metolazone
ESR1_HUMAN

Docking Scores:
-6.48 -8.47 -8.00
Similarity Score:
37.58%
Best Match:
CHEMBL242818

L: Bendroflumethiazide
ESR1_HUMAN

Docking Scores:
-7.34 -8.06 -8.07
Similarity Score:
45.00%
Best Match:
CHEMBL378581

L: Hydralazine
ESR1_HUMAN

Docking Scores:
-7.19 -6.73 -6.46
Similarity Score:
34.52%
Best Match:
CHEMBL223026

L: Hydrochlorothiazide
FABP5_HUMAN

Docking Scores:
-6.94 -5.70 -5.65
Similarity Score:
20.32%
Best Match:
CHEMBL3941588

L: Dolutegravir
FABP5_HUMAN

Docking Scores:
-7.59 -7.28 -7.70
Similarity Score:
27.34%
Best Match:
CHEMBL3950316

L: Metolazone
FABP5_HUMAN

Docking Scores:
-8.38 -6.58 -7.06
Similarity Score:
31.84%
Best Match:
CHEMBL3941588

L: Bendroflumethiazide
FABP5_HUMAN

Docking Scores:
-9.35 -6.71 -6.47
Similarity Score:
21.62%
Best Match:
CHEMBL3941588

L: Hydralazine
FABP5_HUMAN

Docking Scores:
-6.45 -5.18 -5.67
Similarity Score:
17.88%
Best Match:
CHEMBL3941588

L: Hydrochlorothiazide
FYN_HUMAN

Docking Scores:
-7.17
Similarity Score:
31.98%
Best Match:
CHEMBL1993661

L: Dolutegravir
FYN_HUMAN

Docking Scores:
-9.95
Similarity Score:
36.16%
Best Match:
CHEMBL388978

L: Metolazone
FYN_HUMAN

Docking Scores:
-8.46
Similarity Score:
38.76%
Best Match:
CHEMBL12131

L: Bendroflumethiazide
FYN_HUMAN

Docking Scores:
-9.13
Similarity Score:
32.14%
Best Match:
CHEMBL605003

L: Hydralazine
FYN_HUMAN

Docking Scores:
-6.93
Similarity Score:
35.92%
Best Match:
CHEMBL373798

L: Hydrochlorothiazide
GLRA3_HUMAN

Docking Scores:
-6.91 -7.49 -7.65
Similarity Score:
19.73%
Best Match:
CHEMBL4074873

L: Hydrochlorothiazide
GLRA3_HUMAN

Docking Scores:
-7.54
Similarity Score:
19.73%
Best Match:
CHEMBL4074873

L: Dolutegravir
GLRA3_HUMAN

Docking Scores:
-10.00 -9.80 -10.05
Similarity Score:
21.13%
Best Match:
CHEMBL4070615

L: Dolutegravir
GLRA3_HUMAN

Docking Scores:
-10.51
Similarity Score:
21.13%
Best Match:
CHEMBL4070615

L: Metolazone
GLRA3_HUMAN

Docking Scores:
-8.83 -8.51 -8.15
Similarity Score:
25.31%
Best Match:
CHEMBL4074873

L: Metolazone
GLRA3_HUMAN

Docking Scores:
-9.53
Similarity Score:
25.31%
Best Match:
CHEMBL4074873

L: Bendroflumethiazide
GLRA3_HUMAN

Docking Scores:
-9.87 -9.60 -9.86
Similarity Score:
31.09%
Best Match:
CHEMBL4074873

L: Bendroflumethiazide
GLRA3_HUMAN

Docking Scores:
-9.98
Similarity Score:
31.09%
Best Match:
CHEMBL4074873

L: Hydralazine
GLRA3_HUMAN

Docking Scores:
-6.97 -7.21 -7.12
Similarity Score:
11.79%
Best Match:
CHEMBL4070615

L: Hydralazine
GLRA3_HUMAN

Docking Scores:
-7.67
Similarity Score:
11.79%
Best Match:
CHEMBL4070615

L: Hydrochlorothiazide
GRM5_HUMAN

Docking Scores:
-7.09 -6.36 -6.28
Similarity Score:
30.91%
Best Match:
CHEMBL4097918

L: Dolutegravir
GRM5_HUMAN

Docking Scores:
-9.60 -6.83 -7.00
Similarity Score:
42.08%
Best Match:
CHEMBL3928235

L: Metolazone
GRM5_HUMAN

Docking Scores:
-7.43 -4.07 -5.39
Similarity Score:
49.08%
Best Match:
CHEMBL365797

L: Bendroflumethiazide
GRM5_HUMAN

Docking Scores:
-9.73 -5.04 -4.52
Similarity Score:
30.96%
Best Match:
CHEMBL4095476

L: Hydralazine
GRM5_HUMAN

Docking Scores:
-7.26 -7.51 -7.40
Similarity Score:
34.41%
Best Match:
CHEMBL1682803

L: Hydrochlorothiazide
HPGDS_HUMAN

Docking Scores:
-6.73 -6.10 -7.55
Similarity Score:
22.96%
Best Match:
CHEMBL1490019

L: Dolutegravir
HPGDS_HUMAN

Docking Scores:
-9.74 -9.99 -9.54
Similarity Score:
39.33%
Best Match:
CHEMBL1233897

L: Metolazone
HPGDS_HUMAN

Docking Scores:
-7.58 -6.90 -6.70
Similarity Score:
38.50%
Best Match:
CHEMBL3650213

L: Bendroflumethiazide
HPGDS_HUMAN

Docking Scores:
-9.22 -8.19 -7.82
Similarity Score:
26.55%
Best Match:
CHEMBL1490019

L: Hydralazine
HPGDS_HUMAN

Docking Scores:
-6.45 -6.37 -7.55
Similarity Score:
20.00%
Best Match:
CHEMBL3650196

L: Hydrochlorothiazide
HRH1_HUMAN

Docking Scores:
-5.64
Similarity Score:
43.95%
Best Match:
CHEMBL2171041

L: Dolutegravir
HRH1_HUMAN

Docking Scores:
-8.10
Similarity Score:
39.85%
Best Match:
CHEMBL2207280

L: Metolazone
HRH1_HUMAN

Docking Scores:
-5.45
Similarity Score:
38.02%
Best Match:
CHEMBL1910379

L: Bendroflumethiazide
HRH1_HUMAN

Docking Scores:
-7.55
Similarity Score:
36.87%
Best Match:
CHEMBL2171041

L: Hydralazine
HRH1_HUMAN

Docking Scores:
-7.79
Similarity Score:
27.45%
Best Match:
CHEMBL511

L: Hydrochlorothiazide
HYES_HUMAN

Docking Scores:
-7.69 -8.28 -6.68
Similarity Score:
42.11%
Best Match:
CHEMBL2392747

L: Dolutegravir
HYES_HUMAN

Docking Scores:
-10.08 -10.27 -9.19
Similarity Score:
41.15%
Best Match:
CHEMBL3104434

L: Metolazone
HYES_HUMAN

Docking Scores:
-10.11 -10.39 -8.25
Similarity Score:
46.21%
Best Match:
CHEMBL1818405

L: Bendroflumethiazide
HYES_HUMAN

Docking Scores:
-9.79 -10.44 -9.49
Similarity Score:
48.81%
Best Match:
CHEMBL2313199

L: Hydralazine
HYES_HUMAN

Docking Scores:
-7.34 -7.19 -6.84
Similarity Score:
24.69%
Best Match:
CHEMBL2031937

L: Hydrochlorothiazide
IKKB_HUMAN

Docking Scores:
-7.14
Similarity Score:
33.73%
Best Match:
CHEMBL411659

L: Dolutegravir
IKKB_HUMAN

Docking Scores:
-10.04
Similarity Score:
37.62%
Best Match:
CHEMBL1807619

L: Metolazone
IKKB_HUMAN

Docking Scores:
-8.05
Similarity Score:
39.10%
Best Match:
CHEMBL230488

L: Bendroflumethiazide
IKKB_HUMAN

Docking Scores:
-8.70
Similarity Score:
35.96%
Best Match:
CHEMBL230055

L: Hydralazine
IKKB_HUMAN

Docking Scores:
-7.23
Similarity Score:
36.36%
Best Match:
CHEMBL390201

L: Hydrochlorothiazide
MDR1_HUMAN

Docking Scores:
-6.89 -7.02
Similarity Score:
50.93%
Best Match:
CHEMBL498

L: Dolutegravir
MDR1_HUMAN

Docking Scores:
-9.50 -9.90
Similarity Score:
41.58%
Best Match:
CHEMBL1256399

L: Metolazone
MDR1_HUMAN

Docking Scores:
-8.12 -8.73
Similarity Score:
67.36%
Best Match:
CHEMBL376721

L: Bendroflumethiazide
MDR1_HUMAN

Docking Scores:
-9.20 -9.73
Similarity Score:
35.50%
Best Match:
CHEMBL472

L: Hydralazine
MDR1_HUMAN

Docking Scores:
-6.79 -7.23
Similarity Score:
29.09%
Best Match:
CHEMBL2391709

L: Hydrochlorothiazide
MIF_HUMAN

Docking Scores:
-4.93 -5.56 -4.98
Similarity Score:
23.53%
Best Match:
CHEMBL3409229

L: Dolutegravir
MIF_HUMAN

Docking Scores:
-7.59 -7.81 -6.81
Similarity Score:
28.21%
Best Match:
CHEMBL554271

L: Metolazone
MIF_HUMAN

Docking Scores:
-5.39 -6.29 -6.23
Similarity Score:
35.12%
Best Match:
CHEMBL1604170

L: Bendroflumethiazide
MIF_HUMAN

Docking Scores:
-6.99 -8.11 -6.88
Similarity Score:
23.87%
Best Match:
CHEMBL3409229

L: Hydralazine
MIF_HUMAN

Docking Scores:
-5.72 -6.79 -5.41
Similarity Score:
33.75%
Best Match:
CHEMBL224086

L: Hydrochlorothiazide
MK01_HUMAN

Docking Scores:
-6.78 -6.55 -6.04
Similarity Score:
31.98%
Best Match:
CHEMBL1993661

L: Dolutegravir
MK01_HUMAN

Docking Scores:
-9.56 -9.40 -9.26
Similarity Score:
45.33%
Best Match:
CHEMBL3608591

L: Metolazone
MK01_HUMAN

Docking Scores:
-7.39 -8.48 -7.40
Similarity Score:
42.41%
Best Match:
CHEMBL1981782

L: Bendroflumethiazide
MK01_HUMAN

Docking Scores:
-8.98 -8.89 -8.38
Similarity Score:
33.00%
Best Match:
CHEMBL1967544

L: Hydralazine
MK01_HUMAN

Docking Scores:
-6.53 -7.05 -7.13
Similarity Score:
34.29%
Best Match:
CHEMBL86754

L: Hydrochlorothiazide
MK03_HUMAN

Docking Scores:
-7.87 -6.98 -6.81
Similarity Score:
20.86%
Best Match:
CHEMBL3799716

L: Dolutegravir
MK03_HUMAN

Docking Scores:
-10.52 -10.51 -9.56
Similarity Score:
31.64%
Best Match:
CHEMBL1336

L: Metolazone
MK03_HUMAN

Docking Scores:
-7.00 -8.42 -7.71
Similarity Score:
36.56%
Best Match:
CHEMBL1336

L: Bendroflumethiazide
MK03_HUMAN

Docking Scores:
-9.52 -9.13 -8.50
Similarity Score:
24.81%
Best Match:
CHEMBL554497

L: Hydralazine
MK03_HUMAN

Docking Scores:
-6.76 -6.75 -6.85
Similarity Score:
28.70%
Best Match:
CHEMBL3798109

L: Hydrochlorothiazide
MTOR_HUMAN

Docking Scores:
-6.83 -6.86 -7.01
Similarity Score:
33.85%
Best Match:
CHEMBL4059778

L: Dolutegravir
MTOR_HUMAN

Docking Scores:
-11.16 -11.28 -11.17
Similarity Score:
43.10%
Best Match:
CHEMBL3645987

L: Metolazone
MTOR_HUMAN

Docking Scores:
-9.18 -8.96 -8.81
Similarity Score:
38.92%
Best Match:
CHEMBL4087157

L: Bendroflumethiazide
MTOR_HUMAN

Docking Scores:
-9.70 -9.64 -9.78
Similarity Score:
31.88%
Best Match:
CHEMBL4059778

L: Hydralazine
MTOR_HUMAN

Docking Scores:
-6.74 -6.88 -6.89
Similarity Score:
26.50%
Best Match:
CHEMBL1762778

L: Hydrochlorothiazide
NEP_HUMAN

Docking Scores:
-7.96 -6.61 -6.81
Similarity Score:
20.40%
Best Match:
CHEMBL298388

L: Dolutegravir
NEP_HUMAN

Docking Scores:
-9.11 -8.94 -10.74
Similarity Score:
35.46%
Best Match:
CHEMBL3145341

L: Metolazone
NEP_HUMAN

Docking Scores:
-8.17 -7.80 -7.97
Similarity Score:
26.25%
Best Match:
CHEMBL3145346

L: Bendroflumethiazide
NEP_HUMAN

Docking Scores:
-9.59 -8.35 -8.95
Similarity Score:
25.33%
Best Match:
CHEMBL298388

L: Hydralazine
NEP_HUMAN

Docking Scores:
-6.77 -6.81 -6.68
Similarity Score:
23.77%
Best Match:
CHEMBL211943

L: Hydrochlorothiazide
NK1R_HUMAN

Docking Scores:
-6.79 -7.54 -6.59
Similarity Score:
27.27%
Best Match:
CHEMBL345866

L: Dolutegravir
NK1R_HUMAN

Docking Scores:
-10.73 -10.01 -9.69
Similarity Score:
43.62%
Best Match:
CHEMBL340931

L: Metolazone
NK1R_HUMAN

Docking Scores:
-8.67 -8.35 -8.52
Similarity Score:
42.33%
Best Match:
CHEMBL419004

L: Bendroflumethiazide
NK1R_HUMAN

Docking Scores:
-9.06 -8.94 -8.75
Similarity Score:
36.18%
Best Match:
CHEMBL3651896

L: Hydralazine
NK1R_HUMAN

Docking Scores:
-6.78 -6.97 -6.72
Similarity Score:
21.78%
Best Match:
CHEMBL383289

L: Hydrochlorothiazide
NMDE1_HUMAN

Docking Scores:
-7.05 -8.07 -7.33
Similarity Score:
28.29%
Best Match:
CHEMBL2333945

L: Dolutegravir
NMDE1_HUMAN

Docking Scores:
-9.69 -10.69 -9.08
Similarity Score:
16.91%
Best Match:
CHEMBL2333945

L: Metolazone
NMDE1_HUMAN

Docking Scores:
-8.19 -7.91 -7.36
Similarity Score:
31.28%
Best Match:
CHEMBL2333945

L: Bendroflumethiazide
NMDE1_HUMAN

Docking Scores:
-8.58 -8.87 -7.98
Similarity Score:
26.32%
Best Match:
CHEMBL2333945

L: Hydralazine
NMDE1_HUMAN

Docking Scores:
-7.54 -7.32 -7.71
Similarity Score:
9.63%
Best Match:
CHEMBL2333945

L: Hydrochlorothiazide
NMDE2_HUMAN

Docking Scores:
-7.16 -7.27 -7.27
Similarity Score:
16.13%
Best Match:
CHEMBL1779013

L: Dolutegravir
NMDE2_HUMAN

Docking Scores:
-10.79 -10.99 -10.05
Similarity Score:
38.93%
Best Match:
CHEMBL1779013

L: Metolazone
NMDE2_HUMAN

Docking Scores:
-8.89 -8.61 -9.29
Similarity Score:
31.28%
Best Match:
CHEMBL1779013

L: Bendroflumethiazide
NMDE2_HUMAN

Docking Scores:
-10.18 -10.31 -8.42
Similarity Score:
25.14%
Best Match:
CHEMBL444384

L: Hydralazine
NMDE2_HUMAN

Docking Scores:
-7.23 -6.73 -7.86
Similarity Score:
22.81%
Best Match:
CHEMBL2013202

L: Hydrochlorothiazide
NMDZ1_HUMAN

Docking Scores:
-7.41 -7.07 -7.33
Similarity Score:
33.52%
Best Match:
CHEMBL159739

L: Dolutegravir
NMDZ1_HUMAN

Docking Scores:
-9.69 -9.67 -9.08
Similarity Score:
37.87%
Best Match:
CHEMBL354003

L: Metolazone
NMDZ1_HUMAN

Docking Scores:
-8.17 -7.20 -7.36
Similarity Score:
43.20%
Best Match:
CHEMBL349729

L: Bendroflumethiazide
NMDZ1_HUMAN

Docking Scores:
-8.59 -8.82 -7.98
Similarity Score:
30.32%
Best Match:
CHEMBL159739

L: Hydralazine
NMDZ1_HUMAN

Docking Scores:
-7.54 -7.24 -7.71
Similarity Score:
16.31%
Best Match:
CHEMBL164231

L: Hydrochlorothiazide
NOS1_HUMAN

Docking Scores:
-7.72 -8.03 -7.58
Similarity Score:
25.21%
Best Match:
CHEMBL469352

L: Dolutegravir
NOS1_HUMAN

Docking Scores:
-10.55 -10.37 -9.86
Similarity Score:
38.57%
Best Match:
CHEMBL447183

L: Metolazone
NOS1_HUMAN

Docking Scores:
-9.09 -7.74 -8.98
Similarity Score:
38.66%
Best Match:
CHEMBL491897

L: Bendroflumethiazide
NOS1_HUMAN

Docking Scores:
-9.11 -9.59 -9.44
Similarity Score:
25.60%
Best Match:
CHEMBL3142587

L: Hydralazine
NOS1_HUMAN

Docking Scores:
-7.45 -7.68 -6.80
Similarity Score:
36.67%
Best Match:
CHEMBL479014

L: Hydrochlorothiazide
NOS2_HUMAN

Docking Scores:
-7.71 -7.41 -7.85
Similarity Score:
27.41%
Best Match:
CHEMBL490886

L: Dolutegravir
NOS2_HUMAN

Docking Scores:
-9.67 -9.95 -1.68
Similarity Score:
38.57%
Best Match:
CHEMBL447183

L: Metolazone
NOS2_HUMAN

Docking Scores:
-6.78 -7.92 -6.87
Similarity Score:
42.02%
Best Match:
CHEMBL522467

L: Bendroflumethiazide
NOS2_HUMAN

Docking Scores:
-8.91 -10.30 -8.01
Similarity Score:
31.52%
Best Match:
CHEMBL490886

L: Hydralazine
NOS2_HUMAN

Docking Scores:
-6.64 -6.56 -6.87
Similarity Score:
36.67%
Best Match:
CHEMBL479014

L: Hydrochlorothiazide
NTRK1_HUMAN

Docking Scores:
-6.85 -7.03 -7.09
Similarity Score:
34.38%
Best Match:
CHEMBL1996795

L: Dolutegravir
NTRK1_HUMAN

Docking Scores:
-10.73 -10.96 -10.86
Similarity Score:
38.13%
Best Match:
CHEMBL2003524

L: Metolazone
NTRK1_HUMAN

Docking Scores:
-8.35 -8.44 -8.50
Similarity Score:
37.64%
Best Match:
CHEMBL3109646

L: Bendroflumethiazide
NTRK1_HUMAN

Docking Scores:
-10.02 -10.05 -9.75
Similarity Score:
38.30%
Best Match:
CHEMBL1996795

L: Hydralazine
NTRK1_HUMAN

Docking Scores:
-7.21 -7.67 -7.73
Similarity Score:
50.00%
Best Match:
CHEMBL1971519

L: Hydrochlorothiazide
OPRD_HUMAN

Docking Scores:
-6.18 -6.09 -6.46
Similarity Score:
25.93%
Best Match:
CHEMBL339621

L: Dolutegravir
OPRD_HUMAN

Docking Scores:
-9.29 -7.37 -8.47
Similarity Score:
39.18%
Best Match:
CHEMBL3698816

L: Metolazone
OPRD_HUMAN

Docking Scores:
-7.82 -6.91 -7.45
Similarity Score:
45.69%
Best Match:
CHEMBL1332208

L: Bendroflumethiazide
OPRD_HUMAN

Docking Scores:
-8.90 -7.35 -7.80
Similarity Score:
35.64%
Best Match:
CHEMBL192998

L: Hydralazine
OPRD_HUMAN

Docking Scores:
-6.92 -5.75 -6.31
Similarity Score:
29.69%
Best Match:
CHEMBL3185265

L: Hydrochlorothiazide
OPRK_HUMAN

Docking Scores:
-7.17 -6.78 -6.68
Similarity Score:
39.74%
Best Match:
CHEMBL499352

L: Dolutegravir
OPRK_HUMAN

Docking Scores:
-10.73 -10.02 -10.15
Similarity Score:
44.02%
Best Match:
CHEMBL3698799

L: Metolazone
OPRK_HUMAN

Docking Scores:
-9.53 -9.35 -8.12
Similarity Score:
39.62%
Best Match:
CHEMBL1710945

L: Bendroflumethiazide
OPRK_HUMAN

Docking Scores:
-9.88 -9.32 -9.49
Similarity Score:
38.14%
Best Match:
CHEMBL3590190

L: Hydralazine
OPRK_HUMAN

Docking Scores:
-6.61 -6.60 -7.20
Similarity Score:
31.40%
Best Match:
CHEMBL4101810

L: Hydrochlorothiazide
OPRM_MOUSE

Docking Scores:
-6.55 -7.11
Similarity Score:
17.39%
Best Match:
CHEMBL596

L: Dolutegravir
OPRM_MOUSE

Docking Scores:
-10.82 -9.58
Similarity Score:
35.71%
Best Match:
CHEMBL2417568

L: Metolazone
OPRM_MOUSE

Docking Scores:
-8.56 -8.73
Similarity Score:
32.67%
Best Match:
CHEMBL185687

L: Bendroflumethiazide
OPRM_MOUSE

Docking Scores:
-9.38 -8.84
Similarity Score:
27.78%
Best Match:
CHEMBL596

L: Hydralazine
OPRM_MOUSE

Docking Scores:
-7.20 -6.38
Similarity Score:
18.38%
Best Match:
CHEMBL327745

L: Hydrochlorothiazide
OPRX_HUMAN

Docking Scores:
-7.01 -6.34 -6.74
Similarity Score:
33.09%
Best Match:
CHEMBL3942616

L: Dolutegravir
OPRX_HUMAN

Docking Scores:
-9.42 -9.36 -9.30
Similarity Score:
34.55%
Best Match:
CHEMBL511232

L: Metolazone
OPRX_HUMAN

Docking Scores:
-8.73 -7.73 -8.00
Similarity Score:
45.45%
Best Match:
CHEMBL1079941

L: Bendroflumethiazide
OPRX_HUMAN

Docking Scores:
-8.89 -8.72 -8.49
Similarity Score:
35.29%
Best Match:
CHEMBL3942616

L: Hydralazine
OPRX_HUMAN

Docking Scores:
-6.05 -6.41 -6.34
Similarity Score:
26.88%
Best Match:
CHEMBL3139682

L: Hydrochlorothiazide
P2RX3_HUMAN

Docking Scores:
-5.78 -5.94 -5.34
Similarity Score:
27.49%
Best Match:
CHEMBL413145

L: Dolutegravir
P2RX3_HUMAN

Docking Scores:
-6.76 -6.90 -7.17
Similarity Score:
35.05%
Best Match:
CHEMBL3904601

L: Metolazone
P2RX3_HUMAN

Docking Scores:
-6.45 -6.62 -6.98
Similarity Score:
43.33%
Best Match:
CHEMBL413145

L: Bendroflumethiazide
P2RX3_HUMAN

Docking Scores:
-6.67 -6.78 -6.80
Similarity Score:
33.50%
Best Match:
CHEMBL413145

L: Hydralazine
P2RX3_HUMAN

Docking Scores:
-5.51 -5.16 -5.58
Similarity Score:
22.41%
Best Match:
CHEMBL3897696

L: Hydrochlorothiazide
P2Y12_HUMAN

Docking Scores:
-7.60 -7.36 -8.32
Similarity Score:
37.10%
Best Match:
CHEMBL2402253

L: Dolutegravir
P2Y12_HUMAN

Docking Scores:
-10.70 -8.14 -9.84
Similarity Score:
45.02%
Best Match:
CHEMBL3652614

L: Metolazone
P2Y12_HUMAN

Docking Scores:
-7.98 -6.21 -7.98
Similarity Score:
38.64%
Best Match:
CHEMBL591212

L: Bendroflumethiazide
P2Y12_HUMAN

Docking Scores:
-9.08 -9.13 -10.81
Similarity Score:
32.02%
Best Match:
CHEMBL2402248

L: Hydralazine
P2Y12_HUMAN

Docking Scores:
-7.08 -7.29 -7.77
Similarity Score:
25.00%
Best Match:
CHEMBL90195

L: Hydrochlorothiazide
PAR1_HUMAN

Docking Scores:
-7.41
Similarity Score:
24.59%
Best Match:
CHEMBL3143297

L: Dolutegravir
PAR1_HUMAN

Docking Scores:
-10.56
Similarity Score:
39.38%
Best Match:
CHEMBL308052

L: Metolazone
PAR1_HUMAN

Docking Scores:
-8.42
Similarity Score:
40.23%
Best Match:
CHEMBL90698

L: Bendroflumethiazide
PAR1_HUMAN

Docking Scores:
-10.10
Similarity Score:
29.38%
Best Match:
CHEMBL3143297

L: Hydralazine
PAR1_HUMAN

Docking Scores:
-7.02
Similarity Score:
26.26%
Best Match:
CHEMBL292089

L: Hydrochlorothiazide
PDE4B_HUMAN

Docking Scores:
-7.29 -6.94 -7.09
Similarity Score:
31.29%
Best Match:
CHEMBL576479

L: Dolutegravir
PDE4B_HUMAN

Docking Scores:
-10.50 -11.07 -10.99
Similarity Score:
46.67%
Best Match:
CHEMBL3288021

L: Metolazone
PDE4B_HUMAN

Docking Scores:
-8.70 -8.48 -7.98
Similarity Score:
43.26%
Best Match:
CHEMBL380321

L: Bendroflumethiazide
PDE4B_HUMAN

Docking Scores:
-9.81 -10.72 -10.49
Similarity Score:
30.84%
Best Match:
CHEMBL571593

L: Hydralazine
PDE4B_HUMAN

Docking Scores:
-6.96 -7.97 -7.73
Similarity Score:
50.00%
Best Match:
CHEMBL124706

L: Hydrochlorothiazide
PDE5A_HUMAN

Docking Scores:
-7.07 -7.63 -7.55
Similarity Score:
24.88%
Best Match:
CHEMBL2414309

L: Dolutegravir
PDE5A_HUMAN

Docking Scores:
-10.54 -11.10 -10.88
Similarity Score:
45.00%
Best Match:
CHEMBL349299

L: Metolazone
PDE5A_HUMAN

Docking Scores:
-8.23 -9.77 -8.95
Similarity Score:
44.79%
Best Match:
CHEMBL4092040

L: Bendroflumethiazide
PDE5A_HUMAN

Docking Scores:
-9.95 -10.02 -10.31
Similarity Score:
27.39%
Best Match:
CHEMBL2414307

L: Hydralazine
PDE5A_HUMAN

Docking Scores:
-7.65 -6.94 -6.98
Similarity Score:
36.70%
Best Match:
CHEMBL332898

L: Hydrochlorothiazide
PERM_HUMAN

Docking Scores:
-6.38 -6.97 -6.38
Similarity Score:
21.67%
Best Match:
CHEMBL3741401

L: Dolutegravir
PERM_HUMAN

Docking Scores:
-9.33 -9.63 -9.13
Similarity Score:
29.66%
Best Match:
CHEMBL3633249

L: Metolazone
PERM_HUMAN

Docking Scores:
-7.96 -8.12 -8.34
Similarity Score:
29.59%
Best Match:
CHEMBL86

L: Bendroflumethiazide
PERM_HUMAN

Docking Scores:
-8.45 -8.54 -8.25
Similarity Score:
31.40%
Best Match:
CHEMBL2346670

L: Hydralazine
PERM_HUMAN

Docking Scores:
-7.96 -8.08 -7.81
Similarity Score:
100.00%
Best Match:
CHEMBL276832

L: Hydrochlorothiazide
PGH1_SHEEP

Docking Scores:
-6.17 -7.71 -6.50
Similarity Score:
25.13%
Best Match:
CHEMBL280636

L: Dolutegravir
PGH1_SHEEP

Docking Scores:
-8.41 -9.07 -8.72
Similarity Score:
29.89%
Best Match:
CHEMBL24798

L: Metolazone
PGH1_SHEEP

Docking Scores:
-7.49 -9.01 -8.47
Similarity Score:
40.28%
Best Match:
CHEMBL8968

L: Bendroflumethiazide
PGH1_SHEEP

Docking Scores:
-8.28 -9.39 -7.55
Similarity Score:
29.55%
Best Match:
CHEMBL2041695

L: Hydralazine
PGH1_SHEEP

Docking Scores:
-6.97 -7.13 -6.70
Similarity Score:
21.59%
Best Match:
CHEMBL104592

L: Hydrochlorothiazide
PGH2_HUMAN

Docking Scores:
-6.25 -6.61 -6.78
Similarity Score:
36.92%
Best Match:
CHEMBL52872

L: Dolutegravir
PGH2_HUMAN

Docking Scores:
-3.86 -7.07 -8.97
Similarity Score:
34.52%
Best Match:
CHEMBL4096865

L: Metolazone
PGH2_HUMAN

Docking Scores:
-3.65 -6.48 -7.76
Similarity Score:
39.44%
Best Match:
CHEMBL3322421

L: Bendroflumethiazide
PGH2_HUMAN

Docking Scores:
-5.88 -6.61 -7.48
Similarity Score:
35.19%
Best Match:
CHEMBL1766299

L: Hydralazine
PGH2_HUMAN

Docking Scores:
-7.61 -7.27 -7.08
Similarity Score:
28.09%
Best Match:
CHEMBL347198

L: Hydrochlorothiazide
PPAP_HUMAN

Docking Scores:
-8.66
Similarity Score:
11.51%
Best Match:
CHEMBL453954

L: Dolutegravir
PPAP_HUMAN

Docking Scores:
-8.91
Similarity Score:
16.47%
Best Match:
CHEMBL507996

L: Metolazone
PPAP_HUMAN

Docking Scores:
-8.61
Similarity Score:
19.76%
Best Match:
CHEMBL501717

L: Bendroflumethiazide
PPAP_HUMAN

Docking Scores:
-9.77
Similarity Score:
15.82%
Best Match:
CHEMBL501717

L: Hydralazine
PPAP_HUMAN

Docking Scores:
-7.40
Similarity Score:
12.39%
Best Match:
CHEMBL507996

L: Hydrochlorothiazide
PPARG_HUMAN

Docking Scores:
-7.16 -7.27 -6.44
Similarity Score:
40.46%
Best Match:
CHEMBL2338476

L: Dolutegravir
PPARG_HUMAN

Docking Scores:
-10.50 -9.33 -9.86
Similarity Score:
38.69%
Best Match:
CHEMBL238357

L: Metolazone
PPARG_HUMAN

Docking Scores:
-8.70 -8.18 -8.86
Similarity Score:
50.00%
Best Match:
CHEMBL496534

L: Bendroflumethiazide
PPARG_HUMAN

Docking Scores:
-8.62 -8.51 -8.92
Similarity Score:
39.00%
Best Match:
CHEMBL386307

L: Hydralazine
PPARG_HUMAN

Docking Scores:
-6.58 -6.87 -6.31
Similarity Score:
25.00%
Best Match:
CHEMBL202617

L: Hydrochlorothiazide
PRGR_HUMAN

Docking Scores:
-7.53 -7.38 -7.18
Similarity Score:
45.83%
Best Match:
CHEMBL3912431

L: Dolutegravir
PRGR_HUMAN

Docking Scores:
-2.85 -1.59 -6.19
Similarity Score:
38.91%
Best Match:
CHEMBL3315068

L: Metolazone
PRGR_HUMAN

Docking Scores:
-9.60 -8.73 -9.52
Similarity Score:
39.33%
Best Match:
CHEMBL486433

L: Bendroflumethiazide
PRGR_HUMAN

Docking Scores:
-7.72 -7.08 -9.40
Similarity Score:
44.00%
Best Match:
CHEMBL3094480

L: Hydralazine
PRGR_HUMAN

Docking Scores:
-6.88 -6.85 -6.98
Similarity Score:
26.97%
Best Match:
CHEMBL1672540

L: Hydrochlorothiazide
PTGES_HUMAN

Docking Scores:
-6.92
Similarity Score:
30.07%
Best Match:
CHEMBL3092269

L: Dolutegravir
PTGES_HUMAN

Docking Scores:
-8.64
Similarity Score:
38.97%
Best Match:
CHEMBL3901488

L: Metolazone
PTGES_HUMAN

Docking Scores:
-8.43
Similarity Score:
44.38%
Best Match:
CHEMBL2336517

L: Bendroflumethiazide
PTGES_HUMAN

Docking Scores:
-7.82
Similarity Score:
36.94%
Best Match:
CHEMBL1080552

L: Hydralazine
PTGES_HUMAN

Docking Scores:
-6.87
Similarity Score:
26.73%
Best Match:
CHEMBL4093446

L: Hydrochlorothiazide
SC6A4_HUMAN

Docking Scores:
-7.47 -7.39 -7.79
Similarity Score:
30.08%
Best Match:
CHEMBL71

L: Dolutegravir
SC6A4_HUMAN

Docking Scores:
-10.79 -10.63 -11.33
Similarity Score:
37.41%
Best Match:
CHEMBL3818901

L: Metolazone
SC6A4_HUMAN

Docking Scores:
-10.12 -8.98 -10.42
Similarity Score:
42.24%
Best Match:
CHEMBL552341

L: Bendroflumethiazide
SC6A4_HUMAN

Docking Scores:
-10.32 -9.90 -10.24
Similarity Score:
37.93%
Best Match:
CHEMBL209324

L: Hydralazine
SC6A4_HUMAN

Docking Scores:
-7.35 -7.12 -7.40
Similarity Score:
39.29%
Best Match:
CHEMBL1172526

L: Hydrochlorothiazide
SCN9A_HUMAN

Docking Scores:
-6.86
Similarity Score:
35.88%
Best Match:
CHEMBL4060154

L: Dolutegravir
SCN9A_HUMAN

Docking Scores:
-9.23
Similarity Score:
44.24%
Best Match:
CHEMBL3899704

L: Metolazone
SCN9A_HUMAN

Docking Scores:
-7.36
Similarity Score:
39.52%
Best Match:
CHEMBL3684307

L: Bendroflumethiazide
SCN9A_HUMAN

Docking Scores:
-8.47
Similarity Score:
34.10%
Best Match:
CHEMBL3914745

L: Hydralazine
SCN9A_HUMAN

Docking Scores:
-7.09
Similarity Score:
30.83%
Best Match:
CHEMBL3914908

L: Hydrochlorothiazide
TLR4_HUMAN

Docking Scores:
-6.23 -6.51 -6.96
Similarity Score:
25.47%
Best Match:
CHEMBL3823499

L: Dolutegravir
TLR4_HUMAN

Docking Scores:
-9.06 -8.98 -9.02
Similarity Score:
26.88%
Best Match:
CHEMBL1223751

L: Metolazone
TLR4_HUMAN

Docking Scores:
-8.27 -8.09 -7.87
Similarity Score:
24.74%
Best Match:
CHEMBL3823499

L: Bendroflumethiazide
TLR4_HUMAN

Docking Scores:
-8.95 -8.35 -7.96
Similarity Score:
21.67%
Best Match:
CHEMBL3823499

L: Hydralazine
TLR4_HUMAN

Docking Scores:
-6.03 -6.23 -6.36
Similarity Score:
31.36%
Best Match:
CHEMBL3823499

L: Hydrochlorothiazide
TNFA_HUMAN

Docking Scores:
-6.93
Similarity Score:
33.33%
Best Match:
CHEMBL1709705

L: Dolutegravir
TNFA_HUMAN

Docking Scores:
-8.15
Similarity Score:
42.91%
Best Match:
CHEMBL3640333

L: Metolazone
TNFA_HUMAN

Docking Scores:
-7.43
Similarity Score:
46.51%
Best Match:
CHEMBL1465706

L: Bendroflumethiazide
TNFA_HUMAN

Docking Scores:
-8.28
Similarity Score:
42.08%
Best Match:
CHEMBL1607187

L: Hydralazine
TNFA_HUMAN

Docking Scores:
-6.24
Similarity Score:
22.13%
Best Match:
CHEMBL3892871

L: Hydrochlorothiazide
TRBM_HUMAN

Docking Scores:
-6.92 -6.42
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
TRBM_HUMAN

Docking Scores:
-9.31 -8.61
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
TRBM_HUMAN

Docking Scores:
-7.94 -7.88
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
TRBM_HUMAN

Docking Scores:
-9.49 -7.92
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
TRBM_HUMAN

Docking Scores:
-6.54 -6.02
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
TRPM4_HUMAN

Docking Scores:
-6.95 -6.37
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
TRPM4_HUMAN

Docking Scores:
-8.30 -10.07
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
TRPM4_HUMAN

Docking Scores:
-8.24 -6.33
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
TRPM4_HUMAN

Docking Scores:
-8.44 -7.41
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
TRPM4_HUMAN

Docking Scores:
-6.81 -7.30
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
TRPM8_FICAL

Docking Scores:
-7.60
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
TRPM8_FICAL

Docking Scores:
-10.67
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
TRPM8_FICAL

Docking Scores:
-9.70
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
TRPM8_FICAL

Docking Scores:
-10.38
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
TRPM8_FICAL

Docking Scores:
-6.84
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
TRPV1_RAT

Docking Scores:
-6.16
Similarity Score:
31.25%
Best Match:
CHEMBL1779668

L: Dolutegravir
TRPV1_RAT

Docking Scores:
-9.88
Similarity Score:
36.01%
Best Match:
CHEMBL1395445

L: Metolazone
TRPV1_RAT

Docking Scores:
-8.51
Similarity Score:
48.42%
Best Match:
CHEMBL81925

L: Bendroflumethiazide
TRPV1_RAT

Docking Scores:
-9.18
Similarity Score:
32.28%
Best Match:
CHEMBL1290373

L: Hydralazine
TRPV1_RAT

Docking Scores:
-7.24
Similarity Score:
31.34%
Best Match:
CHEMBL342003

L: Hydrochlorothiazide
TRPV2_RABIT

Docking Scores:
-7.06 -7.24
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
TRPV2_RABIT

Docking Scores:
-9.70 -8.78
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
TRPV2_RABIT

Docking Scores:
-7.24 -8.46
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
TRPV2_RABIT

Docking Scores:
-9.42 -8.90
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
TRPV2_RABIT

Docking Scores:
-6.94 -6.85
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
TRPV3_HUMAN

Docking Scores:
-5.30 -6.78
Similarity Score:
26.09%
Best Match:
CHEMBL3692265

L: Dolutegravir
TRPV3_HUMAN

Docking Scores:
-8.30 -8.50
Similarity Score:
36.36%
Best Match:
CHEMBL3696422

L: Metolazone
TRPV3_HUMAN

Docking Scores:
-6.84 -7.07
Similarity Score:
36.68%
Best Match:
CHEMBL3692265

L: Bendroflumethiazide
TRPV3_HUMAN

Docking Scores:
-7.84 -8.01
Similarity Score:
30.45%
Best Match:
CHEMBL3692262

L: Hydralazine
TRPV3_HUMAN

Docking Scores:
-5.57 -6.08
Similarity Score:
20.44%
Best Match:
CHEMBL3692278

L: Hydrochlorothiazide
TRXR1_HUMAN

Docking Scores:
-6.92 -6.89 -6.08
Similarity Score:
N/A
Best Match:
N/A

L: Dolutegravir
TRXR1_HUMAN

Docking Scores:
-8.90 -9.00 -8.48
Similarity Score:
N/A
Best Match:
N/A

L: Metolazone
TRXR1_HUMAN

Docking Scores:
-8.01 -8.03 -7.72
Similarity Score:
N/A
Best Match:
N/A

L: Bendroflumethiazide
TRXR1_HUMAN

Docking Scores:
-9.03 -8.20 -7.19
Similarity Score:
N/A
Best Match:
N/A

L: Hydralazine
TRXR1_HUMAN

Docking Scores:
-7.21 -7.17 -5.86
Similarity Score:
N/A
Best Match:
N/A

L: Hydrochlorothiazide
TRY1_HUMAN

Docking Scores:
-5.48
Similarity Score:
31.11%
Best Match:
CHEMBL1160812

L: Dolutegravir
TRY1_HUMAN

Docking Scores:
-7.47
Similarity Score:
39.70%
Best Match:
CHEMBL324485

L: Metolazone
TRY1_HUMAN

Docking Scores:
-6.28
Similarity Score:
40.10%
Best Match:
CHEMBL1160812

L: Bendroflumethiazide
TRY1_HUMAN

Docking Scores:
-7.07
Similarity Score:
42.42%
Best Match:
CHEMBL1160791

L: Hydralazine
TRY1_HUMAN

Docking Scores:
-5.34
Similarity Score:
28.87%
Best Match:
CHEMBL96433