Fentanyl #94 Output - PAIN-CKB

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Fentanyl #94 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-8.36 -8.48 -9.08
Similarity Score:
60.00%
Best Match:
CHEMBL361061

5HT2A_HUMAN

Docking Scores:
-9.08 -8.90
Similarity Score:
57.69%
Best Match:
CHEMBL352194

5HT2B_HUMAN

Docking Scores:
-8.81 -9.10 -9.38
Similarity Score:
56.67%
Best Match:
CHEMBL3919861

5HT2C_HUMAN

Docking Scores:
-8.49 -9.12
Similarity Score:
57.69%
Best Match:
CHEMBL352194

AA1R_HUMAN

Docking Scores:
-8.66 -8.83 -7.66
Similarity Score:
36.02%
Best Match:
CHEMBL1095812

AA2AR_HUMAN

Docking Scores:
-7.45 -8.09 -8.77
Similarity Score:
47.29%
Best Match:
CHEMBL539454

ACES_HUMAN

Docking Scores:
-9.87 -9.06 -7.24
Similarity Score:
65.43%
Best Match:
CHEMBL141853

ACE_HUMAN

Docking Scores:
-8.15 -8.40 -6.98
Similarity Score:
50.00%
Best Match:
CHEMBL98

ACHA9_HUMAN

Docking Scores:
-6.45
Similarity Score:
28.57%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-6.17 -6.86 -4.84
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-8.03 -2.80
Similarity Score:
73.91%
Best Match:
CHEMBL1243110

ACM4_HUMAN

Docking Scores:
-8.29 -7.78
Similarity Score:
68.48%
Best Match:
CHEMBL3354065

ADRB2_HUMAN

Docking Scores:
-7.73 -8.30 -9.28
Similarity Score:
54.72%
Best Match:
CHEMBL1306990

AGTR2_HUMAN

Docking Scores:
-9.61 -9.85 -9.62
Similarity Score:
36.50%
Best Match:
CHEMBL268815

ALDR_HUMAN

Docking Scores:
-9.41 -7.68 -9.72
Similarity Score:
39.07%
Best Match:
CHEMBL281620

AMPN_HUMAN

Docking Scores:
-8.02 -8.37 -7.69
Similarity Score:
41.38%
Best Match:
CHEMBL3764432

AOFA_HUMAN

Docking Scores:
-10.09 -9.07 -8.63
Similarity Score:
57.45%
Best Match:
CHEMBL3781494

AOFB_HUMAN

Docking Scores:
-8.68 -8.70 -10.07
Similarity Score:
50.51%
Best Match:
CHEMBL3604126

BACE1_HUMAN

Docking Scores:
-6.92 -7.39 -8.46
Similarity Score:
59.60%
Best Match:
CHEMBL2181988

CAH2_HUMAN

Docking Scores:
-7.37 -7.43 -7.59
Similarity Score:
61.62%
Best Match:
CHEMBL182523

CASP1_HUMAN

Docking Scores:
-6.46 -6.95 -6.03
Similarity Score:
46.88%
Best Match:
CHEMBL1221597

CDK5_HUMAN

Docking Scores:
-7.76 -7.70 -7.16
Similarity Score:
43.33%
Best Match:
CHEMBL1998121

CHLE_HUMAN

Docking Scores:
-8.47 -8.99 -9.56
Similarity Score:
52.63%
Best Match:
CHEMBL4077192

CNR1_HUMAN

Docking Scores:
-8.98 -9.23 -9.76
Similarity Score:
55.95%
Best Match:
CHEMBL479095

CNR2_HUMAN

Docking Scores:
-9.18 -9.97
Similarity Score:
70.11%
Best Match:
CHEMBL2338188

COLI_HUMAN

Docking Scores:
-8.18 -7.94 -7.52
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-5.90 -6.36 -5.94
Similarity Score:
25.74%
Best Match:
CHEMBL3425731

CRP_HUMAN

Docking Scores:
-6.37 -5.93
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-5.19
Similarity Score:
31.10%
Best Match:
CHEMBL561812

CXCR4_HUMAN

Docking Scores:
-7.98 -6.61 -7.56
Similarity Score:
41.88%
Best Match:
CHEMBL2371850

DRD2_HUMAN

Docking Scores:
-7.60
Similarity Score:
70.79%
Best Match:
CHEMBL4091231

DRD3_HUMAN

Docking Scores:
-8.25
Similarity Score:
70.79%
Best Match:
CHEMBL4091231

DRD4_HUMAN

Docking Scores:
-8.89 -8.94
Similarity Score:
70.79%
Best Match:
CHEMBL4074104

EDN1_HUMAN

Docking Scores:
-7.64
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-8.30 -8.48 -8.48
Similarity Score:
50.89%
Best Match:
CHEMBL3360843

FABP5_HUMAN

Docking Scores:
-7.92 -6.05 -6.03
Similarity Score:
30.07%
Best Match:
CHEMBL3941588

FYN_HUMAN

Docking Scores:
-7.45
Similarity Score:
43.33%
Best Match:
CHEMBL1998121

GLRA3_HUMAN

Docking Scores:
-9.32 -8.16 -8.77
Similarity Score:
28.19%
Best Match:
CHEMBL4074873

GLRA3_HUMAN

Docking Scores:
-9.63
Similarity Score:
28.19%
Best Match:
CHEMBL4074873

GRM5_HUMAN

Docking Scores:
-8.50 -6.98 -7.52
Similarity Score:
47.52%
Best Match:
CHEMBL2338572

HPGDS_HUMAN

Docking Scores:
-7.25 -7.69 -7.23
Similarity Score:
45.24%
Best Match:
CHEMBL3425957

HRH1_HUMAN

Docking Scores:
-8.53
Similarity Score:
61.82%
Best Match:
CHEMBL1242923

HYES_HUMAN

Docking Scores:
-8.50 -8.26 -8.71
Similarity Score:
68.18%
Best Match:
CHEMBL1672132

IKKB_HUMAN

Docking Scores:
-8.28
Similarity Score:
40.91%
Best Match:
CHEMBL3823257

MDR1_HUMAN

Docking Scores:
-7.93 -8.39
Similarity Score:
46.34%
Best Match:
CHEMBL2398178

MIF_HUMAN

Docking Scores:
-8.01 -8.45 -7.18
Similarity Score:
25.78%
Best Match:
CHEMBL1604170

MK01_HUMAN

Docking Scores:
-7.20 -7.37 -7.83
Similarity Score:
47.06%
Best Match:
CHEMBL3356128

MK03_HUMAN

Docking Scores:
-7.90 -8.11 -8.19
Similarity Score:
38.14%
Best Match:
CHEMBL3113587

MTOR_HUMAN

Docking Scores:
-9.53 -9.08 -8.99
Similarity Score:
39.01%
Best Match:
CHEMBL592619

NEP_HUMAN

Docking Scores:
-7.50 -7.21 -7.56
Similarity Score:
50.00%
Best Match:
CHEMBL467602

NK1R_HUMAN

Docking Scores:
-8.76 -8.19 -7.69
Similarity Score:
63.92%
Best Match:
CHEMBL89245

NMDE1_HUMAN

Docking Scores:
-8.31 -7.38 -7.70
Similarity Score:
28.44%
Best Match:
CHEMBL284237

NMDE2_HUMAN

Docking Scores:
-9.06 -10.50 -6.61
Similarity Score:
43.64%
Best Match:
CHEMBL444384

NMDZ1_HUMAN

Docking Scores:
-8.18 -7.40 -7.70
Similarity Score:
29.46%
Best Match:
CHEMBL419399

NOS1_HUMAN

Docking Scores:
-8.43 -8.29 -8.20
Similarity Score:
43.51%
Best Match:
CHEMBL3216789

NOS2_HUMAN

Docking Scores:
-6.98 -8.72 -8.17
Similarity Score:
44.92%
Best Match:
CHEMBL112747

NTRK1_HUMAN

Docking Scores:
-8.73 -9.20 -9.11
Similarity Score:
43.00%
Best Match:
CHEMBL1984131

OPRD_HUMAN

Docking Scores:
-8.18 -7.13 -7.16
Similarity Score:
100.00%
Best Match:
CHEMBL12391

OPRK_HUMAN

Docking Scores:
-9.67 -8.24 -8.53
Similarity Score:
100.00%
Best Match:
CHEMBL12391

OPRM_MOUSE

Docking Scores:
-8.44 -8.64
Similarity Score:
100.00%
Best Match:
CHEMBL596

OPRX_HUMAN

Docking Scores:
-7.55 -7.44 -7.63
Similarity Score:
80.00%
Best Match:
CHEMBL317152

P2RX3_HUMAN

Docking Scores:
-5.63 -5.63 -6.10
Similarity Score:
42.34%
Best Match:
CHEMBL3669705

P2Y12_HUMAN

Docking Scores:
-8.13 -7.40 -7.05
Similarity Score:
36.72%
Best Match:
CHEMBL88708

PAR1_HUMAN

Docking Scores:
-8.10
Similarity Score:
73.91%
Best Match:
CHEMBL3658401

PDE4B_HUMAN

Docking Scores:
-7.99 -8.12 -8.66
Similarity Score:
39.84%
Best Match:
CHEMBL37386

PDE5A_HUMAN

Docking Scores:
-8.25 -8.36 -8.02
Similarity Score:
31.82%
Best Match:
CHEMBL555171

PERM_HUMAN

Docking Scores:
-7.81 -8.46 -8.03
Similarity Score:
38.94%
Best Match:
CHEMBL2347029

PGH1_SHEEP

Docking Scores:
-9.40 -8.71 -8.01
Similarity Score:
40.83%
Best Match:
CHEMBL3775653

PGH2_HUMAN

Docking Scores:
-4.93 -5.22 -6.33
Similarity Score:
44.63%
Best Match:
CHEMBL49775

PPAP_HUMAN

Docking Scores:
-8.05
Similarity Score:
24.07%
Best Match:
CHEMBL501717

PPARG_HUMAN

Docking Scores:
-7.69 -9.34 -7.47
Similarity Score:
47.11%
Best Match:
CHEMBL340011

PRGR_HUMAN

Docking Scores:
-8.55 -7.85 -9.53
Similarity Score:
48.00%
Best Match:
CHEMBL332502

PTGES_HUMAN

Docking Scores:
-6.97
Similarity Score:
53.33%
Best Match:
CHEMBL4086788

SC6A4_HUMAN

Docking Scores:
-9.64 -9.19 -9.51
Similarity Score:
65.48%
Best Match:
CHEMBL564288

SCN9A_HUMAN

Docking Scores:
-7.54
Similarity Score:
59.09%
Best Match:
CHEMBL2152693

TLR4_HUMAN

Docking Scores:
-8.33 -8.16 -8.74
Similarity Score:
39.05%
Best Match:
CHEMBL1223752

TNFA_HUMAN

Docking Scores:
-7.78
Similarity Score:
44.86%
Best Match:
CHEMBL1612423

TRBM_HUMAN

Docking Scores:
-7.60 -6.70
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-6.92 -7.11
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-9.23
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-8.17
Similarity Score:
47.37%
Best Match:
CHEMBL2057855

TRPV2_RABIT

Docking Scores:
-7.27 -8.55
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.99 -6.85
Similarity Score:
36.24%
Best Match:
CHEMBL3943107

TRXR1_HUMAN

Docking Scores:
-8.00 -7.73 -6.52
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-6.25
Similarity Score:
48.28%
Best Match:
CHEMBL421370