Velvet Journigan #198 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-8.40 -8.44 -9.11
Similarity Score:
40.27%
Best Match:
CHEMBL321190

5HT2A_HUMAN

Docking Scores:
-9.11 -8.29
Similarity Score:
50.71%
Best Match:
CHEMBL1802360

5HT2B_HUMAN

Docking Scores:
-7.97 -9.04 -8.35
Similarity Score:
43.31%
Best Match:
CHEMBL51

5HT2C_HUMAN

Docking Scores:
-8.96 -8.80
Similarity Score:
48.48%
Best Match:
CHEMBL219916

AA1R_HUMAN

Docking Scores:
-8.44 -9.22 -5.34
Similarity Score:
49.06%
Best Match:
CHEMBL559990

AA2AR_HUMAN

Docking Scores:
-8.66 -9.14 -8.71
Similarity Score:
49.06%
Best Match:
CHEMBL559990

ACES_HUMAN

Docking Scores:
-9.77 -9.87 -9.00
Similarity Score:
45.96%
Best Match:
CHEMBL1773485

ACE_HUMAN

Docking Scores:
-8.00 -8.88 -7.13
Similarity Score:
44.17%
Best Match:
CHEMBL3414811

ACHA9_HUMAN

Docking Scores:
-6.70
Similarity Score:
23.83%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-3.29 -5.16 -4.05
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-4.79 5.46
Similarity Score:
51.11%
Best Match:
CHEMBL2059304

ACM4_HUMAN

Docking Scores:
-6.13 -5.88
Similarity Score:
49.19%
Best Match:
CHEMBL2146597

ADRB2_HUMAN

Docking Scores:
-7.91 -7.81 -8.40
Similarity Score:
42.69%
Best Match:
CHEMBL1528906

AGTR2_HUMAN

Docking Scores:
-8.66 -8.47 -8.26
Similarity Score:
33.33%
Best Match:
CHEMBL288705

ALDR_HUMAN

Docking Scores:
-8.83 -8.35 -7.61
Similarity Score:
35.71%
Best Match:
CHEMBL10413

AMPN_HUMAN

Docking Scores:
-8.39 -8.50 -7.99
Similarity Score:
28.03%
Best Match:
CHEMBL2332527

AOFA_HUMAN

Docking Scores:
-8.72 -8.43 -6.36
Similarity Score:
36.96%
Best Match:
CHEMBL1645548

AOFB_HUMAN

Docking Scores:
-7.97 -8.53 -7.01
Similarity Score:
44.07%
Best Match:
CHEMBL2312975

BACE1_HUMAN

Docking Scores:
-7.48 -7.96 -7.95
Similarity Score:
35.90%
Best Match:
CHEMBL1923753

CAH2_HUMAN

Docking Scores:
-8.03 -8.09 -7.89
Similarity Score:
45.34%
Best Match:
CHEMBL3827113

CASP1_HUMAN

Docking Scores:
-6.11 -7.06 -6.27
Similarity Score:
42.76%
Best Match:
CHEMBL1221646

CDK5_HUMAN

Docking Scores:
-6.92 -7.56 -6.73
Similarity Score:
34.72%
Best Match:
CHEMBL1994956

CHLE_HUMAN

Docking Scores:
-9.09 -9.38 -8.77
Similarity Score:
43.36%
Best Match:
CHEMBL452339

CNR1_HUMAN

Docking Scores:
-7.42 -9.29 -10.36
Similarity Score:
51.75%
Best Match:
CHEMBL527071

CNR2_HUMAN

Docking Scores:
-8.50 -9.37
Similarity Score:
54.86%
Best Match:
CHEMBL498152

COLI_HUMAN

Docking Scores:
-7.82 -7.25 -8.10
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-6.76 -6.42 -7.00
Similarity Score:
32.69%
Best Match:
CHEMBL3980370

CRP_HUMAN

Docking Scores:
-6.25 -6.07
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-0.64
Similarity Score:
21.76%
Best Match:
CHEMBL3609011

CXCR4_HUMAN

Docking Scores:
-7.98 -7.24 -7.22
Similarity Score:
38.36%
Best Match:
CHEMBL853

DRD2_HUMAN

Docking Scores:
-8.01
Similarity Score:
51.11%
Best Match:
CHEMBL2059304

DRD3_HUMAN

Docking Scores:
-8.05
Similarity Score:
50.71%
Best Match:
CHEMBL1802360

DRD4_HUMAN

Docking Scores:
-8.19 -7.93
Similarity Score:
43.31%
Best Match:
CHEMBL51

EDN1_HUMAN

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

ESR1_HUMAN

Docking Scores:
-5.57 -7.85 -6.42
Similarity Score:
41.46%
Best Match:
CHEMBL1395826

FABP5_HUMAN

Docking Scores:
-8.04 -6.19 -5.96
Similarity Score:
27.60%
Best Match:
CHEMBL3950316

FYN_HUMAN

Docking Scores:
-7.38
Similarity Score:
43.03%
Best Match:
CHEMBL3335371

GLRA3_HUMAN

Docking Scores:
-8.39 -8.43 -8.32
Similarity Score:
19.68%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-9.43
Similarity Score:
19.68%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-4.10 -2.52 -2.99
Similarity Score:
39.35%
Best Match:
CHEMBL1682808

HPGDS_HUMAN

Docking Scores:
-7.94 -6.77 -5.85
Similarity Score:
31.07%
Best Match:
CHEMBL3425948

HRH1_HUMAN

Docking Scores:
-6.85
Similarity Score:
48.48%
Best Match:
CHEMBL219916

HYES_HUMAN

Docking Scores:
-8.77 -8.70 -8.02
Similarity Score:
40.00%
Best Match:
CHEMBL397694

IKKB_HUMAN

Docking Scores:
-7.85
Similarity Score:
34.23%
Best Match:
CHEMBL484012

MDR1_HUMAN

Docking Scores:
-8.01 -7.67
Similarity Score:
48.48%
Best Match:
CHEMBL219916

MIF_HUMAN

Docking Scores:
-5.79 -6.07 -6.28
Similarity Score:
29.35%
Best Match:
CHEMBL3943378

MK01_HUMAN

Docking Scores:
-7.09 -7.88 -7.27
Similarity Score:
39.78%
Best Match:
CHEMBL1230122

MK03_HUMAN

Docking Scores:
-7.80 -8.21 -7.98
Similarity Score:
33.56%
Best Match:
CHEMBL29197

MTOR_HUMAN

Docking Scores:
-8.66 -9.00 -8.18
Similarity Score:
45.68%
Best Match:
CHEMBL3681182

NEP_HUMAN

Docking Scores:
-6.96 -7.22 -6.93
Similarity Score:
36.20%
Best Match:
CHEMBL213944

NK1R_HUMAN

Docking Scores:
-8.21 -8.59 -8.30
Similarity Score:
48.41%
Best Match:
CHEMBL2313631

NMDE1_HUMAN

Docking Scores:
-8.61 -8.39 -7.74
Similarity Score:
14.84%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-8.00 -8.79 -8.37
Similarity Score:
38.85%
Best Match:
CHEMBL3797704

NMDZ1_HUMAN

Docking Scores:
-8.60 -8.35 -7.74
Similarity Score:
29.76%
Best Match:
CHEMBL354003

NOS1_HUMAN

Docking Scores:
-8.32 -8.50 -7.62
Similarity Score:
34.33%
Best Match:
CHEMBL3217000

NOS2_HUMAN

Docking Scores:
-6.92 -7.77 -7.01
Similarity Score:
33.70%
Best Match:
CHEMBL387348

NTRK1_HUMAN

Docking Scores:
-9.41 -7.54 -8.62
Similarity Score:
36.46%
Best Match:
CHEMBL3673446

OPRD_HUMAN

Docking Scores:
-7.39 -6.86 -6.80
Similarity Score:
48.63%
Best Match:
CHEMBL427683

OPRK_HUMAN

Docking Scores:
-9.26 -7.71 -7.71
Similarity Score:
52.42%
Best Match:
CHEMBL146013

OPRM_MOUSE

Docking Scores:
-8.46 -7.72
Similarity Score:
30.18%
Best Match:
CHEMBL2419123

OPRX_HUMAN

Docking Scores:
-7.15 -7.22 -7.45
Similarity Score:
57.04%
Best Match:
CHEMBL1080485

P2RX3_HUMAN

Docking Scores:
-5.85 -5.71 -6.04
Similarity Score:
40.72%
Best Match:
CHEMBL3948852

P2Y12_HUMAN

Docking Scores:
-7.30 -5.62 -7.62
Similarity Score:
47.40%
Best Match:
CHEMBL91044

PAR1_HUMAN

Docking Scores:
-6.25
Similarity Score:
43.33%
Best Match:
CHEMBL95359

PDE4B_HUMAN

Docking Scores:
-8.26 -8.49 -8.97
Similarity Score:
50.60%
Best Match:
CHEMBL3938524

PDE5A_HUMAN

Docking Scores:
-7.96 -8.47 -8.04
Similarity Score:
41.46%
Best Match:
CHEMBL144400

PERM_HUMAN

Docking Scores:
-8.17 -8.34 -8.57
Similarity Score:
39.46%
Best Match:
CHEMBL1409565

PGH1_SHEEP

Docking Scores:
-5.60 -6.31 -5.49
Similarity Score:
33.51%
Best Match:
CHEMBL421385

PGH2_HUMAN

Docking Scores:
-2.77 -4.59 -6.63
Similarity Score:
35.26%
Best Match:
CHEMBL97411

PPAP_HUMAN

Docking Scores:
-7.96
Similarity Score:
17.50%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-7.71 -6.96 -8.06
Similarity Score:
46.07%
Best Match:
CHEMBL1946567

PRGR_HUMAN

Docking Scores:
-8.80 -8.13 -9.15
Similarity Score:
44.22%
Best Match:
CHEMBL188228

PTGES_HUMAN

Docking Scores:
-5.79
Similarity Score:
37.66%
Best Match:
CHEMBL3770411

SC6A4_HUMAN

Docking Scores:
-9.01 -9.11 -9.18
Similarity Score:
44.68%
Best Match:
CHEMBL514193

SCN9A_HUMAN

Docking Scores:
-6.60
Similarity Score:
36.56%
Best Match:
CHEMBL3941343

TLR4_HUMAN

Docking Scores:
-8.16 -7.59 -7.66
Similarity Score:
37.78%
Best Match:
CHEMBL1223752

TNFA_HUMAN

Docking Scores:
-7.71
Similarity Score:
56.93%
Best Match:
CHEMBL3944621

TRBM_HUMAN

Docking Scores:
-7.33 -8.37
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-7.51 -6.59
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

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

TRPV1_RAT

Docking Scores:
-6.71
Similarity Score:
32.37%
Best Match:
CHEMBL436839

TRPV2_RABIT

Docking Scores:
-7.15 -6.67
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.12 -6.57
Similarity Score:
29.51%
Best Match:
CHEMBL3664218

TRXR1_HUMAN

Docking Scores:
-7.95 -7.59 -6.66
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-5.94
Similarity Score:
40.80%
Best Match:
CHEMBL25184