LH test1 #253 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-6.00 -6.05 -5.61
Similarity Score:
23.08%
Best Match:
CHEMBL191460

5HT2A_HUMAN

Docking Scores:
-5.76 -5.56
Similarity Score:
42.31%
Best Match:
CHEMBL1123

5HT2B_HUMAN

Docking Scores:
-5.44 -5.80 -5.65
Similarity Score:
42.31%
Best Match:
CHEMBL1123

5HT2C_HUMAN

Docking Scores:
-6.04 -5.93
Similarity Score:
42.31%
Best Match:
CHEMBL1123

AA1R_HUMAN

Docking Scores:
-5.37 -5.23 -6.10
Similarity Score:
23.33%
Best Match:
CHEMBL3955407

AA2AR_HUMAN

Docking Scores:
-5.96 -5.99 -5.77
Similarity Score:
21.14%
Best Match:
CHEMBL438823

ACES_HUMAN

Docking Scores:
-6.22 -5.68 -6.53
Similarity Score:
40.32%
Best Match:
CHEMBL1783535

ACE_HUMAN

Docking Scores:
-6.12 -5.49 -5.55
Similarity Score:
48.72%
Best Match:
CHEMBL311988

ACHA9_HUMAN

Docking Scores:
-5.07
Similarity Score:
12.80%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-5.49 -5.81 -6.54
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-6.20 -5.20
Similarity Score:
50.00%
Best Match:
CHEMBL353311

ACM4_HUMAN

Docking Scores:
-6.05 -6.03
Similarity Score:
42.31%
Best Match:
CHEMBL1123

ADRB2_HUMAN

Docking Scores:
-6.36 -6.48 -6.35
Similarity Score:
21.79%
Best Match:
CHEMBL1332942

AGTR2_HUMAN

Docking Scores:
-5.83 -5.78 -5.71
Similarity Score:
18.45%
Best Match:
CHEMBL376286

ALDR_HUMAN

Docking Scores:
-6.18 -6.47 -6.12
Similarity Score:
25.81%
Best Match:
CHEMBL173813

AMPN_HUMAN

Docking Scores:
-5.44 -5.79 -5.71
Similarity Score:
72.22%
Best Match:
CHEMBL27519

AOFA_HUMAN

Docking Scores:
-6.24 -6.06 -6.69
Similarity Score:
25.42%
Best Match:
CHEMBL3605361

AOFB_HUMAN

Docking Scores:
-6.47 -6.55 -6.64
Similarity Score:
25.42%
Best Match:
CHEMBL3605359

BACE1_HUMAN

Docking Scores:
-5.01 -5.05 -5.53
Similarity Score:
38.78%
Best Match:
CHEMBL3586197

CAH2_HUMAN

Docking Scores:
-6.07 -5.97 -5.66
Similarity Score:
46.43%
Best Match:
CHEMBL1946183

CASP1_HUMAN

Docking Scores:
-4.71 -4.91 -4.70
Similarity Score:
35.14%
Best Match:
CHEMBL466565

CDK5_HUMAN

Docking Scores:
-5.81 -5.77 -6.24
Similarity Score:
29.69%
Best Match:
CHEMBL1994526

CHLE_HUMAN

Docking Scores:
-5.77 -5.69 -5.71
Similarity Score:
61.90%
Best Match:
CHEMBL1512936

CNR1_HUMAN

Docking Scores:
-5.85 -6.20 -6.22
Similarity Score:
41.18%
Best Match:
CHEMBL483143

CNR2_HUMAN

Docking Scores:
-6.34 -5.91
Similarity Score:
35.19%
Best Match:
CHEMBL1422818

COLI_HUMAN

Docking Scores:
-6.12 -5.70 -4.93
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-4.13 -4.73 -4.44
Similarity Score:
11.02%
Best Match:
CHEMBL3425731

CRP_HUMAN

Docking Scores:
-5.15 -5.00
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-6.66
Similarity Score:
11.69%
Best Match:
CHEMBL191413

CXCR4_HUMAN

Docking Scores:
-6.20 -4.82 -5.27
Similarity Score:
19.47%
Best Match:
CHEMBL366033

DRD2_HUMAN

Docking Scores:
-6.21
Similarity Score:
28.99%
Best Match:
CHEMBL1909065

DRD3_HUMAN

Docking Scores:
-5.67
Similarity Score:
42.31%
Best Match:
CHEMBL1123

DRD4_HUMAN

Docking Scores:
-5.73 -5.97
Similarity Score:
31.25%
Best Match:
CHEMBL1779058

EDN1_HUMAN

Docking Scores:
-5.24
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-5.97 -5.52 -5.62
Similarity Score:
35.19%
Best Match:
CHEMBL2103774

FABP5_HUMAN

Docking Scores:
-5.50 -4.64 -4.47
Similarity Score:
67.86%
Best Match:
CHEMBL82293

FYN_HUMAN

Docking Scores:
-5.75
Similarity Score:
29.33%
Best Match:
CHEMBL407135

GLRA3_HUMAN

Docking Scores:
-5.78 -6.13 -5.95
Similarity Score:
8.46%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-5.92
Similarity Score:
8.46%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.18 -5.46 -5.72
Similarity Score:
72.97%
Best Match:
CHEMBL90501

HPGDS_HUMAN

Docking Scores:
-5.24 -5.30 -5.16
Similarity Score:
24.32%
Best Match:
CHEMBL1743209

HRH1_HUMAN

Docking Scores:
-6.52
Similarity Score:
29.07%
Best Match:
CHEMBL1276859

HYES_HUMAN

Docking Scores:
-6.27 -6.21 -6.30
Similarity Score:
55.32%
Best Match:
CHEMBL215387

IKKB_HUMAN

Docking Scores:
-4.72
Similarity Score:
34.33%
Best Match:
CHEMBL1762621

MDR1_HUMAN

Docking Scores:
-5.62 -5.74
Similarity Score:
65.52%
Best Match:
CHEMBL27769

MIF_HUMAN

Docking Scores:
-5.27 -5.67 -5.02
Similarity Score:
16.07%
Best Match:
CHEMBL209588

MK01_HUMAN

Docking Scores:
-5.42 -5.02 -5.82
Similarity Score:
23.23%
Best Match:
CHEMBL3752989

MK03_HUMAN

Docking Scores:
-5.55 -5.51 -5.17
Similarity Score:
20.59%
Best Match:
CHEMBL3113587

MTOR_HUMAN

Docking Scores:
-5.79 -5.81 -5.65
Similarity Score:
44.44%
Best Match:
CHEMBL169

NEP_HUMAN

Docking Scores:
-5.69 -6.05 -6.46
Similarity Score:
55.32%
Best Match:
CHEMBL211529

NK1R_HUMAN

Docking Scores:
-5.52 -6.07 -5.39
Similarity Score:
28.09%
Best Match:
CHEMBL283872

NMDE1_HUMAN

Docking Scores:
-6.50 -6.54 -5.73
Similarity Score:
6.38%
Best Match:
CHEMBL284237

NMDE2_HUMAN

Docking Scores:
-5.79 -5.84 -5.35
Similarity Score:
18.84%
Best Match:
CHEMBL3357791

NMDZ1_HUMAN

Docking Scores:
-5.52 -5.87 -5.73
Similarity Score:
12.73%
Best Match:
CHEMBL354003

NOS1_HUMAN

Docking Scores:
-6.46 -6.39 -5.88
Similarity Score:
40.82%
Best Match:
CHEMBL11471

NOS2_HUMAN

Docking Scores:
-6.45 -6.10 -6.65
Similarity Score:
52.17%
Best Match:
CHEMBL7889

NTRK1_HUMAN

Docking Scores:
-5.31 -5.33 -5.49
Similarity Score:
19.05%
Best Match:
CHEMBL1996791

OPRD_HUMAN

Docking Scores:
-5.74 -5.25 -4.93
Similarity Score:
32.18%
Best Match:
CHEMBL3955687

OPRK_HUMAN

Docking Scores:
-5.97 -5.58 -6.21
Similarity Score:
48.72%
Best Match:
CHEMBL3890935

OPRM_MOUSE

Docking Scores:
-5.64 -5.12
Similarity Score:
34.67%
Best Match:
CHEMBL2057689

OPRX_HUMAN

Docking Scores:
-5.23 -5.25 -5.42
Similarity Score:
31.25%
Best Match:
CHEMBL3325747

P2RX3_HUMAN

Docking Scores:
-4.31 -4.22 -4.70
Similarity Score:
18.84%
Best Match:
CHEMBL3669852

P2Y12_HUMAN

Docking Scores:
-5.56 -5.90 -6.11
Similarity Score:
22.03%
Best Match:
CHEMBL299895

PAR1_HUMAN

Docking Scores:
-5.80
Similarity Score:
36.21%
Best Match:
CHEMBL80672

PDE4B_HUMAN

Docking Scores:
-5.89 -5.90 -6.25
Similarity Score:
25.56%
Best Match:
CHEMBL511115

PDE5A_HUMAN

Docking Scores:
-5.58 -6.19 -6.60
Similarity Score:
22.12%
Best Match:
CHEMBL190423

PERM_HUMAN

Docking Scores:
-5.51 -5.63 -5.82
Similarity Score:
21.74%
Best Match:
CHEMBL3145355

PGH1_SHEEP

Docking Scores:
-5.25 -5.86 -5.53
Similarity Score:
39.22%
Best Match:
CHEMBL503071

PGH2_HUMAN

Docking Scores:
-5.55 -5.52 -5.90
Similarity Score:
33.90%
Best Match:
CHEMBL504631

PPAP_HUMAN

Docking Scores:
-6.24
Similarity Score:
5.88%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-4.84 -5.21 -5.10
Similarity Score:
42.55%
Best Match:
CHEMBL230006

PRGR_HUMAN

Docking Scores:
-5.85 -6.00 -5.80
Similarity Score:
35.19%
Best Match:
CHEMBL1162

PTGES_HUMAN

Docking Scores:
-4.90
Similarity Score:
45.45%
Best Match:
CHEMBL566929

SC6A4_HUMAN

Docking Scores:
-5.57 -5.78 -5.95
Similarity Score:
35.19%
Best Match:
CHEMBL2107797

SCN9A_HUMAN

Docking Scores:
-6.58
Similarity Score:
28.09%
Best Match:
CHEMBL206758

TLR4_HUMAN

Docking Scores:
-6.04 -5.43 -5.66
Similarity Score:
29.27%
Best Match:
CHEMBL1223752

TNFA_HUMAN

Docking Scores:
-5.56
Similarity Score:
18.06%
Best Match:
CHEMBL3938524

TRBM_HUMAN

Docking Scores:
-4.90 -5.18
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-6.03 -5.27
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-5.68
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-5.64
Similarity Score:
27.42%
Best Match:
CHEMBL15848

TRPV2_RABIT

Docking Scores:
-6.53 -6.02
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-4.78 -5.26
Similarity Score:
20.55%
Best Match:
CHEMBL73188

TRXR1_HUMAN

Docking Scores:
-5.32 -5.71 -4.66
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-4.55
Similarity Score:
49.02%
Best Match:
CHEMBL323543