mming #352 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-9.76 -10.63 -8.31
Similarity Score:
40.47%
Best Match:
CHEMBL1631533

5HT2A_HUMAN

Docking Scores:
-10.66 -10.36
Similarity Score:
49.56%
Best Match:
CHEMBL55784

5HT2B_HUMAN

Docking Scores:
-9.87 -10.81 -10.19
Similarity Score:
49.56%
Best Match:
CHEMBL55784

5HT2C_HUMAN

Docking Scores:
-10.85 -10.98
Similarity Score:
49.56%
Best Match:
CHEMBL55784

AA1R_HUMAN

Docking Scores:
-8.75 -9.17 -7.53
Similarity Score:
40.64%
Best Match:
CHEMBL405696

AA2AR_HUMAN

Docking Scores:
-8.76 -8.50 -9.20
Similarity Score:
40.64%
Best Match:
CHEMBL405696

ACES_HUMAN

Docking Scores:
-10.59 -9.21 -6.64
Similarity Score:
39.17%
Best Match:
CHEMBL451304

ACE_HUMAN

Docking Scores:
-9.91 -9.44 -8.31
Similarity Score:
33.80%
Best Match:
CHEMBL1242210

ACHA9_HUMAN

Docking Scores:
-7.55
Similarity Score:
23.86%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
0.49 -4.57 -3.64
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-2.80 15.97
Similarity Score:
36.11%
Best Match:
CHEMBL2059307

ACM4_HUMAN

Docking Scores:
-4.11 -7.71
Similarity Score:
36.89%
Best Match:
CHEMBL4065477

ADRB2_HUMAN

Docking Scores:
-8.87 -9.66 -9.96
Similarity Score:
34.54%
Best Match:
CHEMBL1814271

AGTR2_HUMAN

Docking Scores:
-9.02 -8.79 -9.11
Similarity Score:
33.89%
Best Match:
CHEMBL305647

ALDR_HUMAN

Docking Scores:
-9.71 -10.05 -9.10
Similarity Score:
35.63%
Best Match:
CHEMBL303779

AMPN_HUMAN

Docking Scores:
-9.10 -9.75 -8.97
Similarity Score:
30.15%
Best Match:
CHEMBL1828920

AOFA_HUMAN

Docking Scores:
-10.47 -10.07 -8.44
Similarity Score:
32.08%
Best Match:
CHEMBL1796446

AOFB_HUMAN

Docking Scores:
-9.29 -8.86 -11.19
Similarity Score:
35.66%
Best Match:
CHEMBL3604128

BACE1_HUMAN

Docking Scores:
-7.91 -7.99 -9.29
Similarity Score:
40.89%
Best Match:
CHEMBL3261077

CAH2_HUMAN

Docking Scores:
-7.84 -7.76 -7.35
Similarity Score:
32.76%
Best Match:
CHEMBL2047845

CASP1_HUMAN

Docking Scores:
-6.73 -7.37 -6.77
Similarity Score:
39.64%
Best Match:
CHEMBL115336

CDK5_HUMAN

Docking Scores:
-7.66 -7.75 -7.15
Similarity Score:
34.35%
Best Match:
CHEMBL1516890

CHLE_HUMAN

Docking Scores:
-9.45 -9.28 -9.20
Similarity Score:
39.17%
Best Match:
CHEMBL451304

CNR1_HUMAN

Docking Scores:
-8.90 -9.16 -9.81
Similarity Score:
40.82%
Best Match:
CHEMBL514543

CNR2_HUMAN

Docking Scores:
-8.62 -11.06
Similarity Score:
40.82%
Best Match:
CHEMBL514543

COLI_HUMAN

Docking Scores:
-9.09 -8.59 -8.38
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-7.06 -7.38 -7.23
Similarity Score:
24.91%
Best Match:
CHEMBL3425740

CRP_HUMAN

Docking Scores:
-6.75 -6.73
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
2.01
Similarity Score:
36.65%
Best Match:
CHEMBL430116

CXCR4_HUMAN

Docking Scores:
-9.26 -8.40 -8.63
Similarity Score:
39.92%
Best Match:
CHEMBL570300

DRD2_HUMAN

Docking Scores:
-9.01
Similarity Score:
48.02%
Best Match:
CHEMBL3818935

DRD3_HUMAN

Docking Scores:
-10.46
Similarity Score:
48.02%
Best Match:
CHEMBL3818935

DRD4_HUMAN

Docking Scores:
-11.31 -10.43
Similarity Score:
48.02%
Best Match:
CHEMBL3818935

EDN1_HUMAN

Docking Scores:
-8.69
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-6.30 -6.30 -7.81
Similarity Score:
35.08%
Best Match:
CHEMBL4080245

FABP5_HUMAN

Docking Scores:
-5.73 -6.80 -6.86
Similarity Score:
25.93%
Best Match:
CHEMBL3959018

FYN_HUMAN

Docking Scores:
-8.06
Similarity Score:
37.75%
Best Match:
CHEMBL3577124

GLRA3_HUMAN

Docking Scores:
-9.14 -8.08 -7.94
Similarity Score:
22.15%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-8.96
Similarity Score:
22.15%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.33 -0.45 -6.04
Similarity Score:
36.52%
Best Match:
CHEMBL3600423

HPGDS_HUMAN

Docking Scores:
-8.21 -7.43 -8.45
Similarity Score:
35.98%
Best Match:
CHEMBL3425955

HRH1_HUMAN

Docking Scores:
-5.41
Similarity Score:
48.02%
Best Match:
CHEMBL3818935

HYES_HUMAN

Docking Scores:
-9.73 -9.55 -9.65
Similarity Score:
40.39%
Best Match:
CHEMBL1818409

IKKB_HUMAN

Docking Scores:
-8.79
Similarity Score:
35.25%
Best Match:
CHEMBL260092

MDR1_HUMAN

Docking Scores:
-9.69 -9.23
Similarity Score:
31.94%
Best Match:
CHEMBL2074675

MIF_HUMAN

Docking Scores:
-3.70 -7.12 -6.81
Similarity Score:
28.44%
Best Match:
CHEMBL1604170

MK01_HUMAN

Docking Scores:
-7.58 -7.56 -8.06
Similarity Score:
37.55%
Best Match:
CHEMBL3671110

MK03_HUMAN

Docking Scores:
-8.38 -9.06 -9.57
Similarity Score:
30.04%
Best Match:
CHEMBL1336

MTOR_HUMAN

Docking Scores:
-9.92 -10.45 -10.58
Similarity Score:
36.21%
Best Match:
CHEMBL3925661

NEP_HUMAN

Docking Scores:
-8.02 -8.57 -7.81
Similarity Score:
30.24%
Best Match:
CHEMBL301364

NK1R_HUMAN

Docking Scores:
-9.44 -9.15 -9.19
Similarity Score:
44.44%
Best Match:
CHEMBL3651892

NMDE1_HUMAN

Docking Scores:
-8.42 -8.17 -8.56
Similarity Score:
18.58%
Best Match:
CHEMBL284237

NMDE2_HUMAN

Docking Scores:
-9.14 -8.62 -8.04
Similarity Score:
37.45%
Best Match:
CHEMBL569802

NMDZ1_HUMAN

Docking Scores:
-8.52 -8.15 -8.56
Similarity Score:
35.21%
Best Match:
CHEMBL163541

NOS1_HUMAN

Docking Scores:
-9.30 -9.32 -7.73
Similarity Score:
35.29%
Best Match:
CHEMBL3586662

NOS2_HUMAN

Docking Scores:
-6.19 -8.20 30.90
Similarity Score:
34.15%
Best Match:
CHEMBL447183

NTRK1_HUMAN

Docking Scores:
-8.05 -9.22 -9.36
Similarity Score:
40.91%
Best Match:
CHEMBL3962283

OPRD_HUMAN

Docking Scores:
-8.11 -7.38 -8.48
Similarity Score:
40.09%
Best Match:
CHEMBL27460

OPRK_HUMAN

Docking Scores:
-9.88 -8.76 -8.71
Similarity Score:
42.48%
Best Match:
CHEMBL239824

OPRM_MOUSE

Docking Scores:
-9.12 -9.32
Similarity Score:
35.80%
Best Match:
CHEMBL185687

OPRX_HUMAN

Docking Scores:
-8.78 -8.52 -9.01
Similarity Score:
42.48%
Best Match:
CHEMBL239824

P2RX3_HUMAN

Docking Scores:
-6.26 -5.93 -6.71
Similarity Score:
39.45%
Best Match:
CHEMBL3669855

P2Y12_HUMAN

Docking Scores:
-9.60 -5.19 -8.20
Similarity Score:
33.21%
Best Match:
CHEMBL1784191

PAR1_HUMAN

Docking Scores:
-7.55
Similarity Score:
37.46%
Best Match:
CHEMBL71140

PDE4B_HUMAN

Docking Scores:
-9.35 -9.10 -10.09
Similarity Score:
36.89%
Best Match:
CHEMBL251107

PDE5A_HUMAN

Docking Scores:
-8.72 -10.26 -8.98
Similarity Score:
35.43%
Best Match:
CHEMBL551948

PERM_HUMAN

Docking Scores:
-9.24 -9.40 -9.44
Similarity Score:
28.57%
Best Match:
CHEMBL2347034

PGH1_SHEEP

Docking Scores:
-7.19 -8.78 -8.39
Similarity Score:
32.59%
Best Match:
CHEMBL3775653

PGH2_HUMAN

Docking Scores:
-1.24 -5.00 -7.54
Similarity Score:
35.62%
Best Match:
CHEMBL4096865

PPAP_HUMAN

Docking Scores:
-8.43
Similarity Score:
11.49%
Best Match:
CHEMBL501717

PPARG_HUMAN

Docking Scores:
-8.47 -8.82 -8.37
Similarity Score:
34.42%
Best Match:
CHEMBL272962

PRGR_HUMAN

Docking Scores:
-3.26 -2.58 -7.42
Similarity Score:
36.63%
Best Match:
CHEMBL366182

PTGES_HUMAN

Docking Scores:
-7.24
Similarity Score:
39.83%
Best Match:
CHEMBL4092750

SC6A4_HUMAN

Docking Scores:
-10.76 -10.19 -11.40
Similarity Score:
39.65%
Best Match:
CHEMBL3818478

SCN9A_HUMAN

Docking Scores:
-8.15
Similarity Score:
38.05%
Best Match:
CHEMBL3337596

TLR4_HUMAN

Docking Scores:
-8.65 -8.73 -8.40
Similarity Score:
26.58%
Best Match:
CHEMBL2419475

TNFA_HUMAN

Docking Scores:
-7.83
Similarity Score:
34.00%
Best Match:
CHEMBL3640406

TRBM_HUMAN

Docking Scores:
-7.97 -7.50
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-7.41 -7.97
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-10.51
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-8.77
Similarity Score:
44.34%
Best Match:
CHEMBL175383

TRPV2_RABIT

Docking Scores:
-7.01 -7.77
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.43 -7.44
Similarity Score:
31.67%
Best Match:
CHEMBL3696385

TRXR1_HUMAN

Docking Scores:
-8.72 -7.92 -7.40
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-6.70
Similarity Score:
40.15%
Best Match:
CHEMBL436851