Oxycodone #140 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match
Model 1 Model 2 Model 3
5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -9.02 -9.36 -8.14 59.87% CHEMBL29951
5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -8.57 -7.38 N/A 60.90% CHEMBL3695433
5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -8.44 -8.51 -8.60 58.33% CHEMBL445106
5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -7.85 -9.67 N/A 58.33% CHEMBL445106
AA1R_HUMAN adenosine A1 receptor -8.75 -8.51 -6.84 35.88% CHEMBL1544
AA2AR_HUMAN adenosine A2a receptor -7.44 -7.35 -9.34 42.25% CHEMBL541219
ACES_HUMAN acetylcholinesterase (Cartwright blood group) -9.80 -9.61 -8.26 64.71% CHEMBL3764305
ACE_HUMAN angiotensin I converting enzyme -8.57 -8.46 -7.63 46.15% CHEMBL58042
ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -6.73 N/A N/A 27.39% CHEMBL386114
ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -5.68 -2.98 -7.00 N/A N/A
ACM1_HUMAN cholinergic receptor muscarinic 1 -10.32 4.58 N/A 50.00% CHEMBL343236
ACM4_HUMAN cholinergic receptor muscarinic 4 -10.21 -6.87 N/A 48.50% CHEMBL1346
ADRB2_HUMAN adrenoceptor beta 2 -8.33 -8.50 -8.83 49.08% CHEMBL1773265
AGTR2_HUMAN angiotensin II receptor type 2 -8.32 -8.29 -8.18 51.50% CHEMBL154057
ALDR_HUMAN aldo-keto reductase family 1 member B -9.02 -8.24 -7.54 44.77% CHEMBL71562
AMPN_HUMAN alanyl aminopeptidase, membrane -8.11 -8.58 -8.55 40.10% CHEMBL1077584
AOFA_HUMAN monoamine oxidase A -8.95 -10.08 -8.28 40.54% CHEMBL4073457
AOFB_HUMAN monoamine oxidase B -10.39 -8.26 -8.64 42.77% CHEMBL3288304
BACE1_HUMAN beta-secretase 1 -7.34 -7.75 -9.18 48.58% CHEMBL3955763
CAH2_HUMAN carbonic anhydrase 2 -7.56 -8.24 -7.98 45.73% CHEMBL3786651
CASP1_HUMAN caspase 1 -7.33 -7.41 -6.28 45.00% CHEMBL2371932
CDK5_HUMAN cyclin dependent kinase 5 -7.89 -7.65 -5.47 33.04% CHEMBL422897
CHLE_HUMAN butyrylcholinesterase -9.35 -9.12 -9.35 46.43% CHEMBL3410956
CNR1_HUMAN cannabinoid receptor 1 -7.59 -8.42 -8.55 53.46% CHEMBL228349
CNR2_HUMAN cannabinoid receptor 2 -8.87 -9.55 N/A 53.16% CHEMBL223990
COLI_HUMAN proopiomelanocortin -8.01 -8.17 -7.46 N/A N/A
COMT_HUMAN catechol-O-methyltransferase -5.86 -5.75 -5.72 25.55% CHEMBL3425740
CRP_HUMAN C-reactive protein -6.15 -6.24 N/A N/A N/A
CXCR1_HUMAN C-X-C motif chemokine receptor 1 -7.74 N/A N/A 27.64% CHEMBL490688
CXCR4_HUMAN C-X-C motif chemokine receptor 4 -8.66 -7.05 -8.07 36.61% CHEMBL3963508
DRD2_HUMAN dopamine receptor D2 -8.66 N/A N/A 61.94% CHEMBL170976
DRD3_HUMAN dopamine receptor D3 -8.09 N/A N/A 61.94% CHEMBL170976
DRD4_HUMAN dopamine receptor D4 -8.53 -8.57 N/A 52.57% CHEMBL132261
EDN1_HUMAN endothelin 1 -7.38 N/A N/A N/A N/A
ESR1_HUMAN estrogen receptor 1 -7.92 -8.16 -8.16 52.33% CHEMBL33890
FABP5_HUMAN fatty acid binding protein 5 -8.45 -6.12 -6.57 33.33% CHEMBL212860
FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -8.22 N/A N/A 32.29% CHEMBL432649
GLRA3_HUMAN glycine receptor alpha 3 -9.12 -8.68 -8.75 25.93% CHEMBL4070615
GLRA3_HUMAN glycine receptor alpha 3 -9.65 N/A N/A 25.93% CHEMBL4070615
GRM5_HUMAN glutamate metabotropic receptor 5 -10.13 -2.95 -5.29 39.38% CHEMBL1289626
HPGDS_HUMAN hematopoietic prostaglandin D synthase -7.04 -7.05 -6.56 24.69% CHEMBL3698267
HRH1_HUMAN histamine receptor H1 -2.60 N/A N/A 48.47% CHEMBL476839
HYES_HUMAN epoxide hydrolase 2 -8.98 -8.39 -8.09 54.72% CHEMBL1672128
IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -8.46 N/A N/A 36.95% CHEMBL184041
MDR1_HUMAN ATP binding cassette subfamily B member 1 -8.39 -7.90 N/A 74.67% CHEMBL261048
MIF_HUMAN macrophage migration inhibitory factor -6.02 -7.40 -6.57 28.08% CHEMBL1289631
MK01_HUMAN mitogen-activated protein kinase 1 -7.99 -8.51 -7.32 40.23% CHEMBL3752989
MK03_HUMAN mitogen-activated protein kinase 3 -8.18 -8.27 -7.74 34.65% CHEMBL555017
MTOR_HUMAN mechanistic target of rapamycin kinase -9.05 -9.24 -8.62 38.72% CHEMBL4074753
NEP_HUMAN membrane metalloendopeptidase -7.50 -7.64 -7.35 49.15% CHEMBL2062138
NK1R_HUMAN tachykinin receptor 1 -8.72 -8.75 -7.67 48.07% CHEMBL2112368
NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -8.98 -7.84 -7.67 24.02% CHEMBL284237
NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -7.46 -8.03 -6.69 44.37% CHEMBL1289403
NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -7.47 -7.20 -7.67 22.06% CHEMBL419399
NOS1_HUMAN nitric oxide synthase 1 -8.49 -8.68 -7.68 40.78% CHEMBL42968
NOS2_HUMAN nitric oxide synthase 2 -7.31 -8.36 -9.59 40.78% CHEMBL42968
NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -8.47 -8.68 -8.79 34.50% CHEMBL444109
OPRD_HUMAN opioid receptor delta 1 -8.47 -6.82 -7.01 99.34% CHEMBL387016
OPRK_HUMAN opioid receptor kappa 1 -9.52 -9.20 -7.55 99.34% CHEMBL387016
OPRM_MOUSE Mu-type opioid receptor -8.45 -8.31 N/A 100.00% CHEMBL656
OPRX_HUMAN opioid related nociceptin receptor 1 -7.70 -7.01 -7.59 75.93% CHEMBL511142
P2RX3_HUMAN purinergic receptor P2X 3 -6.23 -5.88 -6.07 36.70% CHEMBL3679750
P2Y12_HUMAN purinergic receptor P2Y12 -7.26 -3.41 -7.67 34.31% CHEMBL88108
PAR1_HUMAN coagulation factor II thrombin receptor -9.22 N/A N/A 39.00% CHEMBL334510
PDE4B_HUMAN phosphodiesterase 4B -8.23 -8.81 -9.09 57.50% CHEMBL144499
PDE5A_HUMAN phosphodiesterase 5A -7.78 -8.20 -8.63 36.13% CHEMBL190423
PERM_HUMAN myeloperoxidase -8.33 -8.16 -8.10 37.64% CHEMBL490
PGH1_SHEEP Prostaglandin G/H synthase 1 -5.89 -7.94 -7.43 35.45% CHEMBL24798
PGH2_HUMAN prostaglandin-endoperoxide synthase 2 -1.16 -4.32 -9.85 42.14% CHEMBL276663
PPAP_HUMAN acid phosphatase 3 -7.86 N/A N/A 22.99% CHEMBL507996
PPARG_HUMAN peroxisome proliferator activated receptor gamma -7.26 -6.35 -7.52 47.93% CHEMBL419756
PRGR_HUMAN progesterone receptor -6.90 -6.73 -8.21 40.21% CHEMBL1911657
PTGES_HUMAN prostaglandin E synthase -6.59 N/A N/A 39.60% CHEMBL538661
SC6A4_HUMAN solute carrier family 6 member 4 -9.08 -8.86 -8.69 52.67% CHEMBL52440
SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.27 N/A N/A 42.94% CHEMBL203440
TLR4_HUMAN toll like receptor 4 -7.77 -7.49 -7.61 41.46% CHEMBL3261030
TNFA_HUMAN tumor necrosis factor -7.83 N/A N/A 49.77% CHEMBL2337619
TRBM_HUMAN thrombomodulin -7.24 -7.04 N/A N/A N/A
TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -7.59 -7.06 N/A N/A N/A
TRPM8_FICAL Uncharacterized protein -9.00 N/A N/A N/A N/A
TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -8.61 N/A N/A 44.51% CHEMBL2057858
TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -9.02 -8.00 N/A N/A N/A
TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -6.99 -7.95 N/A 50.00% CHEMBL3664218
TRXR1_HUMAN thioredoxin reductase 1 -8.35 -7.77 -6.80 N/A N/A
TRY1_HUMAN serine protease 1 -6.00 N/A N/A 38.81% CHEMBL69394