Aspirin #71 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

5HT2A_HUMAN

Docking Scores:
-6.45 -6.45
Similarity Score:
43.42%
Best Match:
CHEMBL272942

5HT2B_HUMAN

Docking Scores:
-6.36 -6.53 -6.65
Similarity Score:
44.62%
Best Match:
CHEMBL558

5HT2C_HUMAN

Docking Scores:
-6.40 -6.78
Similarity Score:
43.42%
Best Match:
CHEMBL272942

AA1R_HUMAN

Docking Scores:
-5.58 -5.62 -6.41
Similarity Score:
32.77%
Best Match:
CHEMBL2151131

AA2AR_HUMAN

Docking Scores:
-5.99 -5.92 -6.00
Similarity Score:
32.79%
Best Match:
CHEMBL197359

ACES_HUMAN

Docking Scores:
-6.60 -6.51 -7.23
Similarity Score:
52.78%
Best Match:
CHEMBL139330

ACE_HUMAN

Docking Scores:
-5.96 -6.16 -5.95
Similarity Score:
29.69%
Best Match:
CHEMBL254493

ACHA9_HUMAN

Docking Scores:
-5.08
Similarity Score:
13.51%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-5.20 -6.43 -6.82
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-6.75 -6.89
Similarity Score:
40.26%
Best Match:
CHEMBL4102555

ACM4_HUMAN

Docking Scores:
-6.68 -6.42
Similarity Score:
37.18%
Best Match:
CHEMBL55

ADRB2_HUMAN

Docking Scores:
-6.71 -6.84 -6.72
Similarity Score:
46.59%
Best Match:
CHEMBL1704973

AGTR2_HUMAN

Docking Scores:
-5.94 -6.11 -6.00
Similarity Score:
26.25%
Best Match:
CHEMBL158557

ALDR_HUMAN

Docking Scores:
-7.22 -7.08 -7.23
Similarity Score:
43.52%
Best Match:
CHEMBL110030

AMPN_HUMAN

Docking Scores:
-5.66 -6.67 -6.27
Similarity Score:
25.00%
Best Match:
CHEMBL3805817

AOFA_HUMAN

Docking Scores:
-6.45 -6.62 -6.98
Similarity Score:
45.88%
Best Match:
CHEMBL2391739

AOFB_HUMAN

Docking Scores:
-6.78 -6.62 -6.63
Similarity Score:
53.73%
Best Match:
CHEMBL3278090

BACE1_HUMAN

Docking Scores:
-5.11 -5.52 -5.98
Similarity Score:
35.64%
Best Match:
CHEMBL3586198

CAH2_HUMAN

Docking Scores:
-6.29 -6.27 -6.25
Similarity Score:
59.32%
Best Match:
CHEMBL2333586

CASP1_HUMAN

Docking Scores:
-4.81 -5.70 -4.75
Similarity Score:
39.20%
Best Match:
CHEMBL101145

CDK5_HUMAN

Docking Scores:
-6.17 -6.63 -6.92
Similarity Score:
36.19%
Best Match:
CHEMBL2007296

CHLE_HUMAN

Docking Scores:
-6.69 -6.27 -6.40
Similarity Score:
36.79%
Best Match:
CHEMBL544592

CNR1_HUMAN

Docking Scores:
-5.65 -6.37 -6.45
Similarity Score:
47.83%
Best Match:
CHEMBL243334

CNR2_HUMAN

Docking Scores:
-6.25 -6.47
Similarity Score:
47.83%
Best Match:
CHEMBL243334

COLI_HUMAN

Docking Scores:
-6.37 -6.26 -5.32
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

CRP_HUMAN

Docking Scores:
-4.90 -5.22
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-6.85
Similarity Score:
23.78%
Best Match:
CHEMBL464302

CXCR4_HUMAN

Docking Scores:
-6.56 -5.81 -5.82
Similarity Score:
30.00%
Best Match:
CHEMBL126657

DRD2_HUMAN

Docking Scores:
-5.97
Similarity Score:
40.26%
Best Match:
CHEMBL128313

DRD3_HUMAN

Docking Scores:
-6.08
Similarity Score:
39.24%
Best Match:
CHEMBL334545

DRD4_HUMAN

Docking Scores:
-7.02 -6.67
Similarity Score:
42.86%
Best Match:
CHEMBL59326

EDN1_HUMAN

Docking Scores:
-6.27
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-6.08 -5.90 -5.70
Similarity Score:
63.08%
Best Match:
CHEMBL1082743

FABP5_HUMAN

Docking Scores:
-6.12 -4.52 -4.52
Similarity Score:
53.49%
Best Match:
CHEMBL247298

FYN_HUMAN

Docking Scores:
-6.04
Similarity Score:
32.00%
Best Match:
CHEMBL2004025

GLRA3_HUMAN

Docking Scores:
-6.77 -6.95 -6.81
Similarity Score:
10.96%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-6.59
Similarity Score:
10.96%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.61 -7.52 -7.37
Similarity Score:
51.65%
Best Match:
CHEMBL1682821

HPGDS_HUMAN

Docking Scores:
-6.04 -6.12 -7.11
Similarity Score:
33.33%
Best Match:
CHEMBL2035654

HRH1_HUMAN

Docking Scores:
-7.17
Similarity Score:
38.46%
Best Match:
CHEMBL2158833

HYES_HUMAN

Docking Scores:
-6.41 -6.70 -6.36
Similarity Score:
47.92%
Best Match:
CHEMBL244407

IKKB_HUMAN

Docking Scores:
-6.20
Similarity Score:
32.98%
Best Match:
CHEMBL3318321

MDR1_HUMAN

Docking Scores:
-6.01 -5.60
Similarity Score:
42.00%
Best Match:
CHEMBL9352

MIF_HUMAN

Docking Scores:
-5.01 -6.21 -5.15
Similarity Score:
32.94%
Best Match:
CHEMBL224086

MK01_HUMAN

Docking Scores:
-5.92 -5.73 -6.23
Similarity Score:
33.33%
Best Match:
CHEMBL2004872

MK03_HUMAN

Docking Scores:
-6.05 -6.28 -6.48
Similarity Score:
31.45%
Best Match:
CHEMBL3797548

MTOR_HUMAN

Docking Scores:
-6.33 -6.36 -6.18
Similarity Score:
28.80%
Best Match:
CHEMBL1241300

NEP_HUMAN

Docking Scores:
-6.69 -6.58 -6.88
Similarity Score:
29.69%
Best Match:
CHEMBL254493

NK1R_HUMAN

Docking Scores:
-6.09 -6.16 -6.29
Similarity Score:
30.43%
Best Match:
CHEMBL93909

NMDE1_HUMAN

Docking Scores:
-7.35 -6.92 -7.27
Similarity Score:
16.67%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-6.83 -6.61 -7.18
Similarity Score:
32.14%
Best Match:
CHEMBL161421

NMDZ1_HUMAN

Docking Scores:
-7.32 -6.93 -7.27
Similarity Score:
22.47%
Best Match:
CHEMBL162577

NOS1_HUMAN

Docking Scores:
-6.64 -6.86 -6.31
Similarity Score:
33.03%
Best Match:
CHEMBL4060083

NOS2_HUMAN

Docking Scores:
-5.95 -5.83 -6.25
Similarity Score:
35.92%
Best Match:
CHEMBL1762473

NTRK1_HUMAN

Docking Scores:
-6.38 -6.45 -6.31
Similarity Score:
32.00%
Best Match:
CHEMBL2004025

OPRD_HUMAN

Docking Scores:
-5.82 -4.82 -5.15
Similarity Score:
34.75%
Best Match:
CHEMBL149074

OPRK_HUMAN

Docking Scores:
-5.96 -6.23 -6.36
Similarity Score:
37.36%
Best Match:
CHEMBL942

OPRM_MOUSE

Docking Scores:
-6.50 -5.50
Similarity Score:
28.97%
Best Match:
CHEMBL13470

OPRX_HUMAN

Docking Scores:
-5.82 -5.74 -5.84
Similarity Score:
35.00%
Best Match:
CHEMBL201805

P2RX3_HUMAN

Docking Scores:
-5.33 -4.52 -4.69
Similarity Score:
28.57%
Best Match:
CHEMBL3919713

P2Y12_HUMAN

Docking Scores:
-6.87 -6.37 -6.94
Similarity Score:
33.64%
Best Match:
CHEMBL327374

PAR1_HUMAN

Docking Scores:
-7.46
Similarity Score:
30.00%
Best Match:
CHEMBL2048425

PDE4B_HUMAN

Docking Scores:
-6.36 -7.14 -7.15
Similarity Score:
32.69%
Best Match:
CHEMBL2172710

PDE5A_HUMAN

Docking Scores:
-6.61 -6.38 -6.44
Similarity Score:
40.57%
Best Match:
CHEMBL363889

PERM_HUMAN

Docking Scores:
-6.04 -7.00 -5.98
Similarity Score:
38.24%
Best Match:
CHEMBL309339

PGH1_SHEEP

Docking Scores:
-6.16 -6.65 -6.06
Similarity Score:
100.00%
Best Match:
CHEMBL25

PGH2_HUMAN

Docking Scores:
-6.19 -6.20 -6.55
Similarity Score:
72.60%
Best Match:
CHEMBL1958348

PPAP_HUMAN

Docking Scores:
-6.47
Similarity Score:
22.02%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-5.58 -6.46 -5.74
Similarity Score:
46.99%
Best Match:
CHEMBL207570

PRGR_HUMAN

Docking Scores:
-6.28 -6.24 -6.04
Similarity Score:
32.46%
Best Match:
CHEMBL50849

PTGES_HUMAN

Docking Scores:
-5.88
Similarity Score:
42.72%
Best Match:
CHEMBL3134416

SC6A4_HUMAN

Docking Scores:
-6.16 -6.18 -6.35
Similarity Score:
41.03%
Best Match:
CHEMBL272002

SCN9A_HUMAN

Docking Scores:
-7.07
Similarity Score:
34.15%
Best Match:
CHEMBL3945925

TLR4_HUMAN

Docking Scores:
-5.66 -6.08 -6.26
Similarity Score:
29.70%
Best Match:
CHEMBL1223752

TNFA_HUMAN

Docking Scores:
-5.73
Similarity Score:
27.43%
Best Match:
CHEMBL1700405

TRBM_HUMAN

Docking Scores:
-5.81 -5.48
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-5.91 -5.58
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-6.35
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-6.79
Similarity Score:
33.33%
Best Match:
CHEMBL1779679

TRPV2_RABIT

Docking Scores:
-5.66 -6.16
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-5.23 -5.53
Similarity Score:
24.22%
Best Match:
CHEMBL3692228

TRXR1_HUMAN

Docking Scores:
-6.51 -6.54 -5.09
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-5.51
Similarity Score:
62.35%
Best Match:
CHEMBL148957