Hydromorphone #150 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 -8.66 -8.80 -7.56 64.75% CHEMBL29951
5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -8.78 -7.87 N/A 64.58% CHEMBL3695433
5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -8.83 -8.62 -8.65 62.58% CHEMBL445106
5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -8.21 -8.59 N/A 62.58% CHEMBL445106
AA1R_HUMAN adenosine A1 receptor -7.58 -9.00 -8.09 34.78% CHEMBL1544
AA2AR_HUMAN adenosine A2a receptor -7.77 -8.43 -9.64 42.54% CHEMBL539454
ACES_HUMAN acetylcholinesterase (Cartwright blood group) -10.82 -9.24 -9.58 65.22% CHEMBL3764305
ACE_HUMAN angiotensin I converting enzyme -8.67 -8.96 -8.71 43.39% CHEMBL58042
ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -7.68 N/A N/A 25.75% CHEMBL386114
ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -3.63 -3.26 -5.11 N/A N/A
ACM1_HUMAN cholinergic receptor muscarinic 1 -10.80 1.84 N/A 54.93% CHEMBL343236
ACM4_HUMAN cholinergic receptor muscarinic 4 -10.38 -8.12 N/A 51.95% CHEMBL1346
ADRB2_HUMAN adrenoceptor beta 2 -8.39 -9.19 -9.41 51.95% CHEMBL1346
AGTR2_HUMAN angiotensin II receptor type 2 -8.82 -8.78 -8.79 49.74% CHEMBL154057
ALDR_HUMAN aldo-keto reductase family 1 member B -7.75 -8.74 -7.85 44.17% CHEMBL71562
AMPN_HUMAN alanyl aminopeptidase, membrane -8.44 -8.33 -8.46 39.61% CHEMBL1798008
AOFA_HUMAN monoamine oxidase A -8.72 -9.78 -9.16 43.02% CHEMBL4073457
AOFB_HUMAN monoamine oxidase B -10.07 -9.15 -9.66 45.89% CHEMBL3288304
BACE1_HUMAN beta-secretase 1 -7.20 -7.61 -8.66 50.81% CHEMBL3939118
CAH2_HUMAN carbonic anhydrase 2 -7.36 -7.93 -7.90 50.00% CHEMBL3786651
CASP1_HUMAN caspase 1 -6.40 -7.46 -6.46 46.15% CHEMBL2371932
CDK5_HUMAN cyclin dependent kinase 5 -7.59 -7.51 -5.44 32.11% CHEMBL422897
CHLE_HUMAN butyrylcholinesterase -9.46 -9.35 -9.79 45.37% CHEMBL3410956
CNR1_HUMAN cannabinoid receptor 1 -8.78 -8.50 -9.02 58.62% CHEMBL228349
CNR2_HUMAN cannabinoid receptor 2 -9.16 -9.24 N/A 55.86% CHEMBL426923
COLI_HUMAN proopiomelanocortin -8.26 -8.19 -6.99 N/A N/A
COMT_HUMAN catechol-O-methyltransferase -6.29 -6.61 -6.24 27.23% CHEMBL3425740
CRP_HUMAN C-reactive protein -6.56 -6.35 N/A N/A N/A
CXCR1_HUMAN C-X-C motif chemokine receptor 1 -9.51 N/A N/A 28.76% CHEMBL490688
CXCR4_HUMAN C-X-C motif chemokine receptor 4 -8.30 -6.55 -8.20 36.63% CHEMBL1949739
DRD2_HUMAN dopamine receptor D2 -7.57 N/A N/A 66.90% CHEMBL170976
DRD3_HUMAN dopamine receptor D3 -7.88 N/A N/A 66.90% CHEMBL170976
DRD4_HUMAN dopamine receptor D4 -8.34 -8.42 N/A 57.35% CHEMBL27441
EDN1_HUMAN endothelin 1 -7.93 N/A N/A N/A N/A
ESR1_HUMAN estrogen receptor 1 -9.19 -8.98 -8.99 50.54% CHEMBL33890
FABP5_HUMAN fatty acid binding protein 5 -8.70 -6.09 -6.37 34.55% CHEMBL212860
FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -8.24 N/A N/A 31.66% CHEMBL24828
GLRA3_HUMAN glycine receptor alpha 3 -8.51 -8.46 -8.39 27.34% CHEMBL4070615
GLRA3_HUMAN glycine receptor alpha 3 -9.34 N/A N/A 27.34% CHEMBL4070615
GRM5_HUMAN glutamate metabotropic receptor 5 -7.54 -4.78 -4.90 39.33% CHEMBL1289626
HPGDS_HUMAN hematopoietic prostaglandin D synthase -8.92 -6.80 -6.60 25.45% CHEMBL3698265
HRH1_HUMAN histamine receptor H1 -7.18 N/A N/A 53.02% CHEMBL476839
HYES_HUMAN epoxide hydrolase 2 -9.32 -8.19 -8.55 60.00% CHEMBL1672128
IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -6.94 N/A N/A 38.22% CHEMBL184041
MDR1_HUMAN ATP binding cassette subfamily B member 1 -8.12 -7.69 N/A 82.35% CHEMBL261048
MIF_HUMAN macrophage migration inhibitory factor -5.80 -6.70 -7.02 28.80% CHEMBL1289631
MK01_HUMAN mitogen-activated protein kinase 1 -7.31 -7.80 -7.58 39.39% CHEMBL3752989
MK03_HUMAN mitogen-activated protein kinase 3 -6.73 -7.54 -8.11 32.79% CHEMBL555017
MTOR_HUMAN mechanistic target of rapamycin kinase -8.72 -9.20 -9.06 37.44% CHEMBL4074753
NEP_HUMAN membrane metalloendopeptidase -7.94 -7.89 -7.83 49.70% CHEMBL2062138
NK1R_HUMAN tachykinin receptor 1 -9.33 -8.72 -8.23 45.98% CHEMBL2112368
NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -7.71 -7.44 -7.55 26.06% CHEMBL284237
NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -7.93 -9.66 -6.43 47.10% CHEMBL3357784
NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -7.74 -7.34 -7.55 23.04% CHEMBL419399
NOS1_HUMAN nitric oxide synthase 1 -7.79 -7.94 -8.73 40.10% CHEMBL42968
NOS2_HUMAN nitric oxide synthase 2 -6.11 -8.83 -8.31 40.10% CHEMBL42968
NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -7.61 -7.95 -8.05 33.19% CHEMBL3676077
OPRD_HUMAN opioid receptor delta 1 -7.15 -6.84 -7.11 100.00% CHEMBL398707
OPRK_HUMAN opioid receptor kappa 1 -9.72 -8.40 -7.55 100.00% CHEMBL398707
OPRM_MOUSE Mu-type opioid receptor -7.57 -8.24 N/A 99.27% CHEMBL318361
OPRX_HUMAN opioid related nociceptin receptor 1 -7.74 -7.90 -7.38 78.29% CHEMBL511142
P2RX3_HUMAN purinergic receptor P2X 3 -6.22 -6.52 -6.34 39.02% CHEMBL3679847
P2Y12_HUMAN purinergic receptor P2Y12 -7.56 -4.70 -6.18 35.87% CHEMBL92264
PAR1_HUMAN coagulation factor II thrombin receptor -9.79 N/A N/A 39.78% CHEMBL80942
PDE4B_HUMAN phosphodiesterase 4B -8.12 -8.51 -8.88 61.90% CHEMBL144499
PDE5A_HUMAN phosphodiesterase 5A -8.55 -8.42 -8.25 38.20% CHEMBL190423
PERM_HUMAN myeloperoxidase -8.21 -8.60 -8.53 40.00% CHEMBL490
PGH1_SHEEP Prostaglandin G/H synthase 1 -4.04 -6.34 -7.12 33.96% CHEMBL24798
PGH2_HUMAN prostaglandin-endoperoxide synthase 2 -0.13 -4.23 -6.94 45.21% CHEMBL276663
PPAP_HUMAN acid phosphatase 3 -8.77 N/A N/A 23.43% CHEMBL507996
PPARG_HUMAN peroxisome proliferator activated receptor gamma -7.03 -6.49 -7.08 47.50% CHEMBL419756
PRGR_HUMAN progesterone receptor -7.86 -7.83 -8.60 41.67% CHEMBL1254419
PTGES_HUMAN prostaglandin E synthase -6.57 N/A N/A 38.33% CHEMBL3753433
SC6A4_HUMAN solute carrier family 6 member 4 -9.35 -9.29 -9.16 56.93% CHEMBL52440
SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.04 N/A N/A 44.94% CHEMBL203440
TLR4_HUMAN toll like receptor 4 -8.11 -7.35 -7.84 40.82% CHEMBL3261030
TNFA_HUMAN tumor necrosis factor -8.07 N/A N/A 51.69% CHEMBL2337619
TRBM_HUMAN thrombomodulin -7.55 -6.88 N/A N/A N/A
TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -7.65 -6.98 N/A N/A N/A
TRPM8_FICAL Uncharacterized protein -8.94 N/A N/A N/A N/A
TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -7.33 N/A N/A 46.71% CHEMBL2057858
TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -7.63 -7.98 N/A N/A N/A
TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -6.68 -7.78 N/A 53.18% CHEMBL3664218
TRXR1_HUMAN thioredoxin reductase 1 -8.46 -7.88 -7.12 N/A N/A
TRY1_HUMAN serine protease 1 -5.82 N/A N/A 40.20% CHEMBL44710