asco #274 Output - PAIN-CKB

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asco #274 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-5.62 -5.63 -5.75
Similarity Score:
17.45%
Best Match:
CHEMBL107772

5HT2A_HUMAN

Docking Scores:
-5.18 -5.23
Similarity Score:
24.27%
Best Match:
CHEMBL1909065

5HT2B_HUMAN

Docking Scores:
-5.81 -5.62 -5.67
Similarity Score:
24.27%
Best Match:
CHEMBL1909065

5HT2C_HUMAN

Docking Scores:
-5.47 -5.27
Similarity Score:
24.27%
Best Match:
CHEMBL1909065

AA1R_HUMAN

Docking Scores:
-5.08 -4.86 -5.04
Similarity Score:
19.28%
Best Match:
CHEMBL217076

AA2AR_HUMAN

Docking Scores:
-5.09 -5.15 -4.94
Similarity Score:
23.68%
Best Match:
CHEMBL2042091

ACES_HUMAN

Docking Scores:
-5.97 -6.11 -6.46
Similarity Score:
36.29%
Best Match:
CHEMBL603622

ACE_HUMAN

Docking Scores:
-5.93 -5.36 -5.24
Similarity Score:
24.04%
Best Match:
CHEMBL80667

ACHA9_HUMAN

Docking Scores:
-4.53
Similarity Score:
10.34%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-5.11 -6.34 -5.22
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-5.74 -5.54
Similarity Score:
28.68%
Best Match:
CHEMBL324712

ACM4_HUMAN

Docking Scores:
-5.35 -5.02
Similarity Score:
29.25%
Best Match:
CHEMBL128365

ADRB2_HUMAN

Docking Scores:
-5.51 -6.39 -5.95
Similarity Score:
22.66%
Best Match:
CHEMBL1569630

AGTR2_HUMAN

Docking Scores:
-4.89 -5.00 -5.16
Similarity Score:
16.67%
Best Match:
CHEMBL1668009

ALDR_HUMAN

Docking Scores:
-6.36 -5.90 -6.69
Similarity Score:
35.96%
Best Match:
CHEMBL284616

AMPN_HUMAN

Docking Scores:
-5.71 -6.20 -5.85
Similarity Score:
18.18%
Best Match:
CHEMBL3298946

AOFA_HUMAN

Docking Scores:
-6.28 -6.30 -5.89
Similarity Score:
25.19%
Best Match:
CHEMBL123768

AOFB_HUMAN

Docking Scores:
-5.65 -5.81 -5.72
Similarity Score:
25.90%
Best Match:
CHEMBL4062286

BACE1_HUMAN

Docking Scores:
-5.11 -4.63 -4.82
Similarity Score:
26.87%
Best Match:
CHEMBL4085945

CAH2_HUMAN

Docking Scores:
-6.03 -5.93 -5.45
Similarity Score:
36.80%
Best Match:
CHEMBL3609432

CASP1_HUMAN

Docking Scores:
-5.55 -4.34 -5.37
Similarity Score:
33.33%
Best Match:
CHEMBL400716

CDK5_HUMAN

Docking Scores:
-5.39 -5.27 -6.11
Similarity Score:
14.40%
Best Match:
CHEMBL1974288

CHLE_HUMAN

Docking Scores:
-5.90 -5.66 -5.58
Similarity Score:
31.85%
Best Match:
CHEMBL492233

CNR1_HUMAN

Docking Scores:
-5.24 -5.62 -5.36
Similarity Score:
36.46%
Best Match:
CHEMBL1800732

CNR2_HUMAN

Docking Scores:
-5.21 -5.91
Similarity Score:
36.46%
Best Match:
CHEMBL1800732

COLI_HUMAN

Docking Scores:
-5.91 -5.63 -5.20
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-4.66 -4.53 -5.54
Similarity Score:
14.14%
Best Match:
CHEMBL1089630

CRP_HUMAN

Docking Scores:
-4.49 -4.97
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-6.04
Similarity Score:
14.90%
Best Match:
CHEMBL464012

CXCR4_HUMAN

Docking Scores:
-5.28 -5.51 -4.79
Similarity Score:
22.75%
Best Match:
CHEMBL1221944

DRD2_HUMAN

Docking Scores:
-5.85
Similarity Score:
24.27%
Best Match:
CHEMBL1909065

DRD3_HUMAN

Docking Scores:
-5.41
Similarity Score:
33.57%
Best Match:
CHEMBL1200633

DRD4_HUMAN

Docking Scores:
-5.50 -5.39
Similarity Score:
21.60%
Best Match:
CHEMBL2112284

EDN1_HUMAN

Docking Scores:
-5.00
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-5.25 -4.99 -5.30
Similarity Score:
29.06%
Best Match:
CHEMBL4089824

FABP5_HUMAN

Docking Scores:
-5.30 -4.44 -4.26
Similarity Score:
20.99%
Best Match:
CHEMBL8659

FYN_HUMAN

Docking Scores:
-5.13
Similarity Score:
23.90%
Best Match:
CHEMBL1097700

GLRA3_HUMAN

Docking Scores:
-5.52 -6.16 -6.08
Similarity Score:
9.83%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-5.19
Similarity Score:
9.83%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-5.61 -6.46 -6.44
Similarity Score:
18.24%
Best Match:
CHEMBL3086720

HPGDS_HUMAN

Docking Scores:
-5.04 -4.53 -6.33
Similarity Score:
27.18%
Best Match:
CHEMBL1743209

HRH1_HUMAN

Docking Scores:
-5.44
Similarity Score:
21.36%
Best Match:
CHEMBL3983211

HYES_HUMAN

Docking Scores:
-6.28 -6.08 -5.78
Similarity Score:
35.65%
Best Match:
CHEMBL249447

IKKB_HUMAN

Docking Scores:
-4.97
Similarity Score:
37.25%
Best Match:
CHEMBL1253688

MDR1_HUMAN

Docking Scores:
-4.92 -5.45
Similarity Score:
46.60%
Best Match:
CHEMBL2074725

MIF_HUMAN

Docking Scores:
-4.93 -5.25 -5.17
Similarity Score:
30.26%
Best Match:
CHEMBL2375653

MK01_HUMAN

Docking Scores:
-5.35 -4.70 -4.67
Similarity Score:
27.36%
Best Match:
CHEMBL319244

MK03_HUMAN

Docking Scores:
-5.36 -5.46 -5.70
Similarity Score:
25.12%
Best Match:
CHEMBL555017

MTOR_HUMAN

Docking Scores:
-4.96 -5.49 -4.93
Similarity Score:
38.24%
Best Match:
CHEMBL1911631

NEP_HUMAN

Docking Scores:
-6.21 -6.03 -6.08
Similarity Score:
21.10%
Best Match:
CHEMBL434492

NK1R_HUMAN

Docking Scores:
-5.15 -5.50 -4.74
Similarity Score:
21.53%
Best Match:
CHEMBL435564

NMDE1_HUMAN

Docking Scores:
-6.17 -6.06 -6.30
Similarity Score:
8.59%
Best Match:
CHEMBL284237

NMDE2_HUMAN

Docking Scores:
-5.53 -5.45 -5.31
Similarity Score:
14.18%
Best Match:
CHEMBL218546

NMDZ1_HUMAN

Docking Scores:
-6.17 -6.13 -6.30
Similarity Score:
11.39%
Best Match:
CHEMBL248438

NOS1_HUMAN

Docking Scores:
-6.55 -6.62 -6.32
Similarity Score:
14.41%
Best Match:
CHEMBL298404

NOS2_HUMAN

Docking Scores:
-6.15 -5.61 -7.30
Similarity Score:
23.47%
Best Match:
CHEMBL195352

NTRK1_HUMAN

Docking Scores:
-4.69 -5.21 -5.04
Similarity Score:
23.36%
Best Match:
CHEMBL444109

OPRD_HUMAN

Docking Scores:
-4.87 -4.19 -4.54
Similarity Score:
32.33%
Best Match:
CHEMBL1161423

OPRK_HUMAN

Docking Scores:
-5.44 -5.24 -5.64
Similarity Score:
38.98%
Best Match:
CHEMBL1773748

OPRM_MOUSE

Docking Scores:
-4.92 -5.03
Similarity Score:
20.69%
Best Match:
CHEMBL405663

OPRX_HUMAN

Docking Scores:
-5.26 -5.34 -4.91
Similarity Score:
19.51%
Best Match:
CHEMBL3262362

P2RX3_HUMAN

Docking Scores:
-4.72 -4.17 -4.79
Similarity Score:
16.75%
Best Match:
CHEMBL3679817

P2Y12_HUMAN

Docking Scores:
-5.08 -6.19 -5.80
Similarity Score:
20.00%
Best Match:
CHEMBL250832

PAR1_HUMAN

Docking Scores:
-5.32
Similarity Score:
26.14%
Best Match:
CHEMBL2012500

PDE4B_HUMAN

Docking Scores:
-5.59 -5.99 -6.00
Similarity Score:
32.52%
Best Match:
CHEMBL2063002

PDE5A_HUMAN

Docking Scores:
-5.59 -5.90 -6.00
Similarity Score:
16.47%
Best Match:
CHEMBL190364

PERM_HUMAN

Docking Scores:
-5.10 -5.43 -5.08
Similarity Score:
14.81%
Best Match:
CHEMBL3920217

PGH1_SHEEP

Docking Scores:
-5.73 -5.41 -5.18
Similarity Score:
43.22%
Best Match:
CHEMBL502799

PGH2_HUMAN

Docking Scores:
-5.59 -5.53 -5.45
Similarity Score:
48.28%
Best Match:
CHEMBL463571

PPAP_HUMAN

Docking Scores:
-5.80
Similarity Score:
8.89%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-4.86 -5.49 -5.21
Similarity Score:
45.45%
Best Match:
CHEMBL2178586

PRGR_HUMAN

Docking Scores:
-5.66 -5.63 -5.31
Similarity Score:
42.70%
Best Match:
CHEMBL3695598

PTGES_HUMAN

Docking Scores:
-6.28
Similarity Score:
29.21%
Best Match:
CHEMBL3289107

SC6A4_HUMAN

Docking Scores:
-5.66 -5.76 -5.51
Similarity Score:
32.33%
Best Match:
CHEMBL185169

SCN9A_HUMAN

Docking Scores:
-5.69
Similarity Score:
17.03%
Best Match:
CHEMBL3942132

TLR4_HUMAN

Docking Scores:
-5.29 -5.34 -5.48
Similarity Score:
34.85%
Best Match:
CHEMBL4071705

TNFA_HUMAN

Docking Scores:
-4.87
Similarity Score:
19.53%
Best Match:
CHEMBL3983488

TRBM_HUMAN

Docking Scores:
-5.91 -5.96
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-5.74 -5.53
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-5.34
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-6.15
Similarity Score:
38.30%
Best Match:
CHEMBL104647

TRPV2_RABIT

Docking Scores:
-6.23 -6.02
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-3.86 -5.08
Similarity Score:
13.29%
Best Match:
CHEMBL3664218

TRXR1_HUMAN

Docking Scores:
-6.40 -5.94 -4.53
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-5.86
Similarity Score:
30.77%
Best Match:
CHEMBL318001