Sal-EOM #485 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-7.30 -8.05 -6.64
Similarity Score:
26.17%
Best Match:
CHEMBL82488

5HT2A_HUMAN

Docking Scores:
-8.84 -6.25
Similarity Score:
41.55%
Best Match:
CHEMBL3676849

5HT2B_HUMAN

Docking Scores:
-8.53 -8.64 -8.88
Similarity Score:
33.88%
Best Match:
CHEMBL1909065

5HT2C_HUMAN

Docking Scores:
-8.18 -8.54
Similarity Score:
33.88%
Best Match:
CHEMBL1909065

AA1R_HUMAN

Docking Scores:
-7.91 -8.37 -3.53
Similarity Score:
23.16%
Best Match:
CHEMBL162752

AA2AR_HUMAN

Docking Scores:
-5.99 -6.46 -5.40
Similarity Score:
22.22%
Best Match:
CHEMBL2381770

ACES_HUMAN

Docking Scores:
-9.31 -8.63 -7.97
Similarity Score:
37.33%
Best Match:
CHEMBL4633410

ACE_HUMAN

Docking Scores:
-8.31 -8.50 -6.04
Similarity Score:
27.33%
Best Match:
CHEMBL284898

ACHA9_HUMAN

Docking Scores:
-6.83
Similarity Score:
13.66%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
4.58 0.10 -4.92
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-6.30 10.80
Similarity Score:
35.42%
Best Match:
CHEMBL75217

ACM4_HUMAN

Docking Scores:
-8.02 -5.84
Similarity Score:
34.92%
Best Match:
CHEMBL285440

ADRB2_HUMAN

Docking Scores:
-6.94 -6.04 -8.77
Similarity Score:
33.73%
Best Match:
CHEMBL1431082

AGTR2_HUMAN

Docking Scores:
-7.69 -7.88 -7.58
Similarity Score:
18.37%
Best Match:
CHEMBL214592

ALDR_HUMAN

Docking Scores:
-8.37 -7.74 -7.33
Similarity Score:
29.45%
Best Match:
CHEMBL284616

AMPN_HUMAN

Docking Scores:
-8.87 -9.13 -8.82
Similarity Score:
22.86%
Best Match:
CHEMBL1821978

AOFA_HUMAN

Docking Scores:
-7.65 -7.49 -0.91
Similarity Score:
31.82%
Best Match:
CHEMBL488917

AOFB_HUMAN

Docking Scores:
-7.32 -2.86 -4.11
Similarity Score:
33.33%
Best Match:
CHEMBL1830818

BACE1_HUMAN

Docking Scores:
-7.04 -8.23 -8.47
Similarity Score:
33.08%
Best Match:
CHEMBL3586204

CAH2_HUMAN

Docking Scores:
-7.51 -7.99 -8.15
Similarity Score:
33.85%
Best Match:
CHEMBL3137782

CASP1_HUMAN

Docking Scores:
-6.04 -6.73 -6.61
Similarity Score:
36.42%
Best Match:
CHEMBL1222905

CDK5_HUMAN

Docking Scores:
-6.49 -5.55 -5.38
Similarity Score:
21.63%
Best Match:
CHEMBL422897

CHLE_HUMAN

Docking Scores:
-9.12 -8.62 -8.79
Similarity Score:
28.57%
Best Match:
CHEMBL3586200

CNR1_HUMAN

Docking Scores:
-7.76 -5.96 -6.50
Similarity Score:
30.77%
Best Match:
CHEMBL233637

CNR2_HUMAN

Docking Scores:
-5.65 -9.58
Similarity Score:
30.77%
Best Match:
CHEMBL233637

COLI_HUMAN

Docking Scores:
-7.15 -7.45 -5.96
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-5.69 -5.95 -5.39
Similarity Score:
21.68%
Best Match:
CHEMBL1091981

CRP_HUMAN

Docking Scores:
-5.91 -5.65
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-0.28
Similarity Score:
24.18%
Best Match:
CHEMBL246733

CXCR4_HUMAN

Docking Scores:
-7.83 -7.09 -7.76
Similarity Score:
21.07%
Best Match:
CHEMBL1221944

DRD2_HUMAN

Docking Scores:
-7.13
Similarity Score:
41.55%
Best Match:
CHEMBL3676849

DRD3_HUMAN

Docking Scores:
-7.85
Similarity Score:
41.55%
Best Match:
CHEMBL3676849

DRD4_HUMAN

Docking Scores:
-8.05 -8.44
Similarity Score:
31.01%
Best Match:
CHEMBL3318841

EDN1_HUMAN

Docking Scores:
-7.29
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-5.05 -5.12 -4.99
Similarity Score:
39.11%
Best Match:
CHEMBL486386

FABP5_HUMAN

Docking Scores:
-8.88 -6.71 -6.17
Similarity Score:
38.66%
Best Match:
CHEMBL4288603

FYN_HUMAN

Docking Scores:
-7.21
Similarity Score:
29.07%
Best Match:
CHEMBL506247

GLRA3_HUMAN

Docking Scores:
-7.75 -7.61 -7.77
Similarity Score:
14.64%
Best Match:
CHEMBL4074873

GLRA3_HUMAN

Docking Scores:
-9.86
Similarity Score:
14.64%
Best Match:
CHEMBL4074873

GRM5_HUMAN

Docking Scores:
0.70 0.01 -0.09
Similarity Score:
23.03%
Best Match:
CHEMBL92162

HPGDS_HUMAN

Docking Scores:
-5.55 -6.94 -6.10
Similarity Score:
17.68%
Best Match:
CHEMBL4463046

HRH1_HUMAN

Docking Scores:
2.57
Similarity Score:
25.74%
Best Match:
CHEMBL1201203

HYES_HUMAN

Docking Scores:
-8.52 -8.01 -8.61
Similarity Score:
34.06%
Best Match:
CHEMBL4207574

IKKB_HUMAN

Docking Scores:
-7.25
Similarity Score:
28.93%
Best Match:
CHEMBL3318173

MDR1_HUMAN

Docking Scores:
-7.94 -7.58
Similarity Score:
51.61%
Best Match:
CHEMBL1829519

MIF_HUMAN

Docking Scores:
-5.32 -5.63 -5.61
Similarity Score:
25.88%
Best Match:
CHEMBL211882

MK01_HUMAN

Docking Scores:
-6.82 -6.84 -7.62
Similarity Score:
29.07%
Best Match:
CHEMBL506247

MK03_HUMAN

Docking Scores:
-6.06 -6.66 -6.58
Similarity Score:
26.21%
Best Match:
CHEMBL1934583

MTOR_HUMAN

Docking Scores:
-9.48 -8.46 -8.95
Similarity Score:
36.10%
Best Match:
CHEMBL428496

NEP_HUMAN

Docking Scores:
-8.21 -7.68 -7.47
Similarity Score:
30.95%
Best Match:
CHEMBL4070297

NK1R_HUMAN

Docking Scores:
-8.05 -6.88 -6.75
Similarity Score:
40.60%
Best Match:
CHEMBL378984

NMDE1_HUMAN

Docking Scores:
-8.66 -7.86 -6.86
Similarity Score:
10.99%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-7.35 -6.75 -6.02
Similarity Score:
31.82%
Best Match:
CHEMBL4169479

NMDZ1_HUMAN

Docking Scores:
-8.81 -7.87 -6.86
Similarity Score:
17.49%
Best Match:
CHEMBL325890

NOS1_HUMAN

Docking Scores:
-7.22 -7.25 -7.48
Similarity Score:
18.18%
Best Match:
CHEMBL4530822

NOS2_HUMAN

Docking Scores:
-5.88 -7.47 -4.00
Similarity Score:
21.43%
Best Match:
CHEMBL1037

NTRK1_HUMAN

Docking Scores:
-7.80 -7.52 -8.19
Similarity Score:
22.13%
Best Match:
CHEMBL444109

OPRD_HUMAN

Docking Scores:
-7.14 -6.66 -7.18
Similarity Score:
73.23%
Best Match:
CHEMBL3330670

OPRK_HUMAN

Docking Scores:
-9.75 -8.01 -8.12
Similarity Score:
100.00%
Best Match:
CHEMBL272939

OPRM_MOUSE

Docking Scores:
-7.97 -8.29
Similarity Score:
27.72%
Best Match:
CHEMBL2205421

OPRX_HUMAN

Docking Scores:
-7.64 -6.62 -7.36
Similarity Score:
32.50%
Best Match:
CHEMBL3581762

P2RX3_HUMAN

Docking Scores:
-6.32 -6.02 -5.76
Similarity Score:
25.48%
Best Match:
CHEMBL3669841

P2Y12_HUMAN

Docking Scores:
-7.03 -1.22 -6.62
Similarity Score:
26.97%
Best Match:
CHEMBL420980

PAR1_HUMAN

Docking Scores:
-6.13
Similarity Score:
30.37%
Best Match:
CHEMBL2012510

PDE4B_HUMAN

Docking Scores:
-7.22 -8.16 -7.93
Similarity Score:
28.21%
Best Match:
CHEMBL2063002

PDE5A_HUMAN

Docking Scores:
-6.67 -7.41 -7.49
Similarity Score:
25.31%
Best Match:
CHEMBL497293

PERM_HUMAN

Docking Scores:
-8.03 -7.96 -7.91
Similarity Score:
23.13%
Best Match:
CHEMBL278555

PGH1_SHEEP

Docking Scores:
-2.76 -4.14 -2.59
Similarity Score:
33.81%
Best Match:
CHEMBL447689

PGH2_HUMAN

Docking Scores:
5.13 2.52 -6.30
Similarity Score:
38.06%
Best Match:
CHEMBL516139

PPAP_HUMAN

Docking Scores:
-8.23 -8.07
Similarity Score:
9.70%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-7.50 -6.26 -7.48
Similarity Score:
40.34%
Best Match:
CHEMBL3337640

PRGR_HUMAN

Docking Scores:
-6.98 -5.00 -8.69
Similarity Score:
31.44%
Best Match:
CHEMBL1676

PTGES_HUMAN

Docking Scores:
-5.76
Similarity Score:
27.35%
Best Match:
CHEMBL3289107

SC6A4_HUMAN

Docking Scores:
-8.79 -8.80 -8.28
Similarity Score:
38.46%
Best Match:
CHEMBL2012104

SCN9A_HUMAN

Docking Scores:
-6.13
Similarity Score:
32.06%
Best Match:
CHEMBL381488

TLR4_HUMAN

Docking Scores:
-7.01 -6.60 -6.74
Similarity Score:
31.76%
Best Match:
CHEMBL1910027

TNFA_HUMAN

Docking Scores:
-7.68 -7.35 -5.76
Similarity Score:
27.57%
Best Match:
CHEMBL3983488

TRBM_HUMAN

Docking Scores:
-6.67 -6.79
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-6.90 -6.31
Similarity Score:
15.03%
Best Match:
CHEMBL1408302

TRPM8_FICAL

Docking Scores:
-9.44
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-8.15
Similarity Score:
33.51%
Best Match:
CHEMBL99940

TRPV2_RABIT

Docking Scores:
-7.12 -6.94
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.20 -5.96
Similarity Score:
19.17%
Best Match:
CHEMBL3664218

TRXR1_HUMAN

Docking Scores:
-9.31 -7.80 -6.66
Similarity Score:
15.95%
Best Match:
CHEMBL4281382

TRY1_HUMAN

Docking Scores:
-5.68
Similarity Score:
38.05%
Best Match:
CHEMBL101030