Acetaminophen #56 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match Prediction
Model 1 Model 2 Model 3 Result Confidence Level
5HT1A_HUMAN 5-hydroxytryptamine receptor 1A -6.03 -5.84 -5.96 52.83% CHEMBL129661 Active 72.22%
5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -6.67 -6.64 -5.91 52.83% CHEMBL129661 N/A N/A
5HT1D_HUMAN 5-hydroxytryptamine receptor 1D -6.23 -6.00 -6.71 52.83% CHEMBL129661 N/A N/A
5HT1E_HUMAN 5-hydroxytryptamine receptor 1E -6.56 -6.21 -6.43 25.00% CHEMBL39 Inactive 66.29%
5HT1F_HUMAN 5-hydroxytryptamine receptor 1F -6.72 -5.71 -6.13 32.17% CHEMBL184994 Inactive 71.37%
5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -6.12 -6.18 N/A 48.94% CHEMBL277120 N/A N/A
5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -6.01 -5.91 -6.02 44.62% CHEMBL57135 N/A N/A
5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -6.24 -6.31 N/A 44.62% CHEMBL57135 N/A N/A
5HT4R_HUMAN 5-hydroxytryptamine receptor 4 -6.23 -6.25 -6.18 28.83% CHEMBL339936 Inactive 65.12%
5HT5A_HUMAN 5-hydroxytryptamine receptor 5A -6.04 -6.23 -6.18 63.83% CHEMBL24462 Active 87.85%
5HT6R_HUMAN 5-hydroxytryptamine receptor 6 -5.85 -5.65 -5.79 49.12% CHEMBL9666 Inactive 57.86%
5HT7R_HUMAN 5-hydroxytryptamine receptor 7 -6.09 -5.98 -5.77 54.90% CHEMBL3262404 Active 88.96%
AA1R_HUMAN adenosine A1 receptor -5.56 -5.73 -5.75 36.27% CHEMBL1814055 N/A N/A
AA2AR_HUMAN adenosine A2a receptor -5.97 -5.95 -5.88 36.27% CHEMBL1814055 N/A N/A
AA2BR_HUMAN adenosine A2b receptor -5.72 -6.33 -5.94 36.27% CHEMBL1814055 Active 56.42%
AA3R_HUMAN adenosine A3 receptor -6.30 -6.15 -5.74 36.27% CHEMBL1814055 Active 54.31%
ACM1_HUMAN cholinergic receptor muscarinic 1 -6.40 -7.19 N/A 37.63% CHEMBL1092460 N/A N/A
ACM2_HUMAN cholinergic receptor muscarinic 2 -6.08 -6.00 -6.28 46.25% CHEMBL83982 Active 75.69%
ACM3_HUMAN cholinergic receptor muscarinic 3 -5.70 -6.49 -6.33 46.25% CHEMBL83982 Inactive 52.02%
ACM4_HUMAN cholinergic receptor muscarinic 4 -6.42 -5.80 N/A 34.09% CHEMBL7568 N/A N/A
ACM5_HUMAN cholinergic receptor muscarinic 5 -6.39 -6.22 -6.28 33.33% CHEMBL3354078 Inactive 69.75%
ACTHR_HUMAN melanocortin 2 receptor -7.34 -6.61 -5.72 N/A N/A N/A N/A
ADA1D_HUMAN adrenoceptor alpha 1D -5.61 -6.22 -5.61 42.25% CHEMBL114669 Active 68.87%
ADA2A_HUMAN adrenoceptor alpha 2A -6.34 -6.29 -5.76 44.83% CHEMBL3289540 Active 67.80%
ADA2B_HUMAN adrenoceptor alpha 2B -6.48 -6.56 -6.45 34.09% CHEMBL7568 Active 56.40%
ADA2C_HUMAN adrenoceptor alpha 2C -5.87 -5.51 -5.07 46.00% CHEMBL1879790 Active 67.21%
ADRB1_HUMAN adrenoceptor beta 1 -5.95 -6.04 -6.04 41.18% CHEMBL13102 Active 50.94%
ADRB2_HUMAN adrenoceptor beta 2 -6.09 -6.39 -6.58 41.18% CHEMBL13102 N/A N/A
ADRB3_HUMAN adrenoceptor beta 3 -6.46 -6.74 -6.43 41.18% CHEMBL13102 N/A N/A
AGTR2_HUMAN angiotensin II receptor type 2 -5.86 -6.03 -5.90 29.00% CHEMBL290829 N/A N/A
BKRB2_HUMAN bradykinin receptor B2 -6.21 -6.75 -6.20 26.73% CHEMBL110652 Inactive 75.11%
CALCR_HUMAN calcitonin receptor -5.58 -5.31 -6.08 14.84% CHEMBL2369895 Active 71.16%
CCKAR_HUMAN cholecystokinin A receptor -5.48 -5.50 -6.57 34.91% CHEMBL443825 Inactive 96.61%
CCR1_HUMAN C-C motif chemokine receptor 1 -5.77 -6.29 -5.25 32.41% CHEMBL2208416 Inactive 98.64%
CCR2_HUMAN C-C motif chemokine receptor 2 -5.21 -5.27 -5.35 35.63% CHEMBL246520 Inactive 91.42%
CCR4_HUMAN C-C motif chemokine receptor 4 -5.41 -5.78 -6.19 27.43% CHEMBL600196 Inactive 79.05%
CCR5_HUMAN C-C motif chemokine receptor 5 -5.56 -5.34 -5.33 36.99% CHEMBL433635 Inactive 99.51%
CLTR1_HUMAN cysteinyl leukotriene receptor 1 -6.23 -6.89 -6.63 31.82% CHEMBL129866 Inactive 97.40%
CNR1_HUMAN cannabinoid receptor 1 -5.92 -6.14 -6.28 49.33% CHEMBL200094 N/A N/A
CNR2_HUMAN cannabinoid receptor 2 -6.16 -6.08 N/A 41.82% CHEMBL2336559 N/A N/A
CXCR1_HUMAN C-X-C motif chemokine receptor 1 -6.41 N/A N/A 50.79% CHEMBL184637 N/A N/A
CXCR2_HUMAN C-X-C motif chemokine receptor 2 -5.85 -5.40 -5.24 44.12% CHEMBL25573 Inactive 61.20%
CXCR3_HUMAN C-X-C motif chemokine receptor 3 -6.09 -6.11 -6.06 32.38% CHEMBL245271 Inactive 98.87%
CXCR4_HUMAN C-X-C motif chemokine receptor 4 -6.73 -5.63 -5.82 29.33% CHEMBL2347630 N/A N/A
DRD1_HUMAN dopamine receptor D1 -6.12 -5.93 -5.67 35.56% CHEMBL25236 Inactive 63.56%
DRD2_HUMAN dopamine receptor D2 -6.47 N/A N/A 50.91% CHEMBL447809 N/A N/A
DRD3_HUMAN dopamine receptor D3 -6.05 N/A N/A 49.12% CHEMBL2165674 N/A N/A
DRD4_HUMAN dopamine receptor D4 -6.38 -6.37 N/A 55.22% CHEMBL184772 N/A N/A
DRD5_HUMAN dopamine receptor D5 -6.05 -6.17 -6.24 33.98% CHEMBL394080 Inactive 86.45%
EDNRA_HUMAN endothelin receptor type A -5.10 -6.79 -5.14 25.55% CHEMBL10905 Inactive 87.63%
GABR1_HUMAN gamma-aminobutyric acid type B receptor subunit 1 -6.03 -6.39 -6.68 13.68% CHEMBL392394 Inactive 90.79%
GASR_HUMAN cholecystokinin B receptor -5.96 -6.00 -5.64 34.91% CHEMBL443825 Inactive 91.03%
GRM1_HUMAN glutamate metabotropic receptor 1 -6.73 -6.42 -6.29 32.53% CHEMBL254575 Inactive 81.84%
GRM2_HUMAN glutamate metabotropic receptor 2 -6.32 -6.70 -6.60 32.95% CHEMBL468800 Inactive 73.86%
GRM3_HUMAN glutamate metabotropic receptor 3 -7.08 -7.23 -6.84 24.18% CHEMBL1630807 Inactive 70.58%
GRM4_HUMAN glutamate metabotropic receptor 4 -5.05 -5.03 -4.88 39.77% CHEMBL3609733 Inactive 92.11%
GRM5_HUMAN glutamate metabotropic receptor 5 -6.77 -6.97 -7.16 41.18% CHEMBL1080481 N/A N/A
GRM6_HUMAN glutamate metabotropic receptor 6 -6.32 -6.31 -6.33 23.23% CHEMBL2418359 Inactive 95.10%
GRM7_HUMAN glutamate metabotropic receptor 7 -6.33 -5.94 -6.71 26.24% CHEMBL3560612 Inactive 99.88%
GRM8_HUMAN glutamate metabotropic receptor 8 -5.66 -5.92 -5.88 26.24% CHEMBL3560612 Inactive 98.63%
HRH1_HUMAN histamine receptor H1 -6.90 N/A N/A 40.58% CHEMBL1940414 N/A N/A
HRH2_HUMAN histamine receptor H2 -7.18 -6.39 -7.30 30.17% CHEMBL194837 Active 82.87%
HRH3_HUMAN histamine receptor H3 -5.73 -5.50 -5.81 47.89% CHEMBL2387297 Active 93.52%
HRH4_HUMAN histamine receptor H4 -5.86 -5.73 -5.83 30.53% CHEMBL128958 Inactive 50.11%
MC3R_HUMAN melanocortin 3 receptor -6.05 -5.47 -5.71 25.37% CHEMBL377231 Inactive 74.23%
MC4R_HUMAN melanocortin 4 receptor -4.76 -5.20 -4.81 39.71% CHEMBL1728670 Inactive 78.06%
MC5R_HUMAN melanocortin 5 receptor -5.80 -6.52 -5.43 26.05% CHEMBL3896315 Inactive 74.19%
MSHR_HUMAN melanocortin 1 receptor -6.51 -5.30 -6.63 24.18% CHEMBL606399 Inactive 64.53%
NK1R_HUMAN tachykinin receptor 1 -5.62 -6.00 -5.77 37.97% CHEMBL40262 N/A N/A
NK2R_HUMAN tachykinin receptor 2 -5.89 -5.54 -5.83 28.70% CHEMBL303119 Inactive 99.35%
NPBW1_HUMAN neuropeptides B and W receptor 1 -5.50 -5.17 -5.34 23.49% CHEMBL1987717 Inactive 89.63%
NPFF1_HUMAN neuropeptide FF receptor 1 -5.20 -5.34 -5.64 28.07% CHEMBL3361420 Inactive 57.49%
NPSR1_HUMAN neuropeptide S receptor 1 -5.59 -6.11 -6.10 30.10% CHEMBL1289780 Inactive 84.79%
NPY1R_HUMAN neuropeptide Y receptor Y1 -6.57 -6.52 -5.70 30.43% CHEMBL2046861 N/A N/A
NPY2R_HUMAN neuropeptide Y receptor Y2 -5.57 -5.31 -5.34 35.71% CHEMBL1287954 Inactive 52.31%
NPY4R_HUMAN neuropeptide Y receptor Y4 -6.08 -5.67 -5.46 19.09% CHEMBL2440199 Active 94.31%
NPY5R_HUMAN neuropeptide Y receptor Y5 -5.89 -6.09 -6.07 51.52% CHEMBL77355 Inactive 71.34%
OPRD_HUMAN opioid receptor delta 1 -5.63 -4.77 -5.46 43.04% CHEMBL416930 N/A N/A
OPRK_HUMAN opioid receptor kappa 1 -5.65 -6.23 -6.55 41.18% CHEMBL283552 N/A N/A
OPRM_HUMAN opioid receptor mu 1 -5.81 -5.17 -5.59 46.88% CHEMBL371268 Inactive 79.44%
OPRX_HUMAN opioid related nociceptin receptor 1 -5.31 -5.57 -5.43 38.96% CHEMBL3665425 N/A N/A
PTAFR_HUMAN platelet activating factor receptor -6.15 -6.04 -5.98 31.82% CHEMBL54106 Inactive 77.02%
TAAR1_HUMAN trace amine associated receptor 1 -6.25 -6.44 -5.82 40.68% CHEMBL1445005 Active 77.40%
TSHR_HUMAN thyroid stimulating hormone receptor -5.86 -6.18 -5.97 30.19% CHEMBL3911383 Inactive 90.32%
V1AR_HUMAN arginine vasopressin receptor 1A -6.32 -5.53 -6.57 33.71% CHEMBL106229 Inactive 93.74%
VIPR1_HUMAN vasoactive intestinal peptide receptor 1 -5.57 -5.81 -5.52 17.69% CHEMBL1784685 N/A N/A