anti-pain drug v3 #222 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

Ligand Protein Symbol Approved Name Docking Scores Similarity
Score
Best Match
Model 1 Model 2 Model 3
Amantadine 5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -6.04 -6.27 -6.51 22.22% CHEMBL146942
Alfentanil 5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -7.92 -8.19 -8.21 38.51% CHEMBL148110
Pimecrolimus 5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -9.61 -7.18 10.39 31.96% CHEMBL442
Levacetylmethadol 5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -7.46 -7.24 -8.02 42.37% CHEMBL79693
Rofecoxib 5HT1B_HUMAN 5-hydroxytryptamine receptor 1B -10.04 -9.37 -9.26 31.16% CHEMBL188486
Amantadine 5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -5.91 -6.29 N/A 40.00% CHEMBL334255
Alfentanil 5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -8.30 -7.10 N/A 43.15% CHEMBL4066435
Pimecrolimus 5HT2A_HUMAN 5-hydroxytryptamine receptor 2A 0.63 20.42 N/A 45.83% CHEMBL473781
Levacetylmethadol 5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -8.16 -7.04 N/A 56.41% CHEMBL936
Rofecoxib 5HT2A_HUMAN 5-hydroxytryptamine receptor 2A -9.28 -9.46 N/A 46.55% CHEMBL1084976
Amantadine 5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -6.13 -5.40 -5.97 23.68% CHEMBL452719
Alfentanil 5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -8.27 -7.80 -8.56 38.29% CHEMBL1729
Pimecrolimus 5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -6.33 -3.18 4.07 35.95% CHEMBL1909065
Levacetylmethadol 5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -7.57 -7.59 -7.73 56.38% CHEMBL1277769
Rofecoxib 5HT2B_HUMAN 5-hydroxytryptamine receptor 2B -8.55 -8.80 -8.40 35.59% CHEMBL521805
Amantadine 5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -5.68 -6.03 N/A 40.00% CHEMBL334255
Alfentanil 5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -7.98 -8.46 N/A 38.29% CHEMBL1729
Pimecrolimus 5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -6.51 3.42 N/A 35.95% CHEMBL1909065
Levacetylmethadol 5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -7.52 -7.73 N/A 58.89% CHEMBL517712
Rofecoxib 5HT2C_HUMAN 5-hydroxytryptamine receptor 2C -8.99 -9.56 N/A 46.55% CHEMBL1084721
Amantadine AA1R_HUMAN adenosine A1 receptor -5.58 -5.75 -6.12 14.29% CHEMBL3955407
Alfentanil AA1R_HUMAN adenosine A1 receptor -7.54 -7.79 -7.69 33.33% CHEMBL4065629
Pimecrolimus AA1R_HUMAN adenosine A1 receptor 7.44 -5.98 35.07 35.81% CHEMBL2070507
Levacetylmethadol AA1R_HUMAN adenosine A1 receptor -7.44 -7.69 -5.69 32.47% CHEMBL3350613
Rofecoxib AA1R_HUMAN adenosine A1 receptor -9.35 -9.21 -9.43 25.86% CHEMBL16997
Amantadine AA2AR_HUMAN adenosine A2a receptor -5.84 -6.34 -6.05 13.95% CHEMBL3314905
Alfentanil AA2AR_HUMAN adenosine A2a receptor -7.42 -7.28 -8.12 35.45% CHEMBL554840
Pimecrolimus AA2AR_HUMAN adenosine A2a receptor 2.50 -0.57 35.27 36.80% CHEMBL1950653
Levacetylmethadol AA2AR_HUMAN adenosine A2a receptor -6.90 -6.93 -7.87 32.47% CHEMBL3350613
Rofecoxib AA2AR_HUMAN adenosine A2a receptor -9.50 -9.28 -9.60 36.44% CHEMBL2042091
Amantadine ACES_HUMAN acetylcholinesterase (Cartwright blood group) -6.21 -6.11 -6.72 56.52% CHEMBL345241
Alfentanil ACES_HUMAN acetylcholinesterase (Cartwright blood group) -9.09 -8.79 -6.61 38.46% CHEMBL141853
Pimecrolimus ACES_HUMAN acetylcholinesterase (Cartwright blood group) 14.37 14.41 9.26 41.28% CHEMBL1080631
Levacetylmethadol ACES_HUMAN acetylcholinesterase (Cartwright blood group) -8.94 -7.78 -9.44 42.99% CHEMBL1773490
Rofecoxib ACES_HUMAN acetylcholinesterase (Cartwright blood group) -8.92 -9.06 -10.59 33.61% CHEMBL52347
Amantadine ACE_HUMAN angiotensin I converting enzyme -5.78 -5.97 -5.44 21.43% CHEMBL110870
Alfentanil ACE_HUMAN angiotensin I converting enzyme -7.98 -8.77 -7.54 43.88% CHEMBL78731
Pimecrolimus ACE_HUMAN angiotensin I converting enzyme -9.82 4.87 ? ? ?
Levacetylmethadol ACE_HUMAN angiotensin I converting enzyme -7.42 -7.32 -6.58 49.11% CHEMBL1168
Rofecoxib ACE_HUMAN angiotensin I converting enzyme -8.13 -8.60 -7.38 37.96% CHEMBL80667
Amantadine ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -5.39 N/A N/A 5.59% CHEMBL386114
Alfentanil ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -6.31 N/A N/A 28.44% CHEMBL386114
Pimecrolimus ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -8.27 N/A N/A 26.67% CHEMBL386114
Levacetylmethadol ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -6.42 N/A N/A 24.31% CHEMBL386114
Rofecoxib ACHA9_HUMAN cholinergic receptor nicotinic alpha 9 subunit -6.92 N/A N/A 20.20% CHEMBL386114
Amantadine ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -6.96 -7.13 -7.66 N/A N/A
Alfentanil ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -4.74 -2.82 -5.23 N/A N/A
Pimecrolimus ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit ? ? ? N/A N/A
Levacetylmethadol ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -2.02 -2.46 -4.34 N/A N/A
Rofecoxib ACHB2_HUMAN cholinergic receptor nicotinic beta 2 subunit -6.03 -8.79 -7.49 N/A N/A
Amantadine ACM1_HUMAN cholinergic receptor muscarinic 1 -7.16 -5.22 N/A 56.52% CHEMBL75880
Alfentanil ACM1_HUMAN cholinergic receptor muscarinic 1 -8.00 3.38 N/A 49.64% CHEMBL1243233
Pimecrolimus ACM1_HUMAN cholinergic receptor muscarinic 1 46.08 104.68 N/A 45.98% CHEMBL363895
Levacetylmethadol ACM1_HUMAN cholinergic receptor muscarinic 1 -8.23 4.71 N/A 73.42% CHEMBL285440
Rofecoxib ACM1_HUMAN cholinergic receptor muscarinic 1 -10.39 -4.07 N/A 58.52% CHEMBL2312368
Amantadine ACM4_HUMAN cholinergic receptor muscarinic 4 -6.99 -6.13 N/A 56.52% CHEMBL75880
Alfentanil ACM4_HUMAN cholinergic receptor muscarinic 4 -6.95 -7.64 N/A 44.16% CHEMBL1223804
Pimecrolimus ACM4_HUMAN cholinergic receptor muscarinic 4 52.15 17.08 N/A 42.11% CHEMBL313738
Levacetylmethadol ACM4_HUMAN cholinergic receptor muscarinic 4 -8.01 -4.44 N/A 73.42% CHEMBL285440
Rofecoxib ACM4_HUMAN cholinergic receptor muscarinic 4 -10.42 -9.33 N/A 42.75% CHEMBL1180285
Amantadine ADRB2_HUMAN adrenoceptor beta 2 -6.16 -6.11 -6.06 19.40% CHEMBL1332942
Alfentanil ADRB2_HUMAN adrenoceptor beta 2 -7.60 -8.62 -8.44 40.40% CHEMBL1459608
Pimecrolimus ADRB2_HUMAN adrenoceptor beta 2 -6.14 9.06 13.36 33.58% CHEMBL3973386
Levacetylmethadol ADRB2_HUMAN adrenoceptor beta 2 -6.21 -7.06 -8.31 46.73% CHEMBL1082607
Rofecoxib ADRB2_HUMAN adrenoceptor beta 2 -9.03 -8.98 -8.85 38.31% CHEMBL446840
Amantadine AGTR2_HUMAN angiotensin II receptor type 2 -5.87 -5.99 -5.83 8.08% CHEMBL376286
Alfentanil AGTR2_HUMAN angiotensin II receptor type 2 -7.79 -8.13 -7.90 34.50% CHEMBL348157
Pimecrolimus AGTR2_HUMAN angiotensin II receptor type 2 -10.54 -9.96 -10.55 27.59% CHEMBL3350599
Levacetylmethadol AGTR2_HUMAN angiotensin II receptor type 2 -8.08 -7.85 -7.97 32.35% CHEMBL3350599
Rofecoxib AGTR2_HUMAN angiotensin II receptor type 2 -8.89 -8.83 -9.06 26.47% CHEMBL217673
Amantadine ALDR_HUMAN aldo-keto reductase family 1 member B -6.35 -6.40 -6.22 9.09% CHEMBL173813
Alfentanil ALDR_HUMAN aldo-keto reductase family 1 member B -8.03 -7.79 -7.50 34.50% CHEMBL344057
Pimecrolimus ALDR_HUMAN aldo-keto reductase family 1 member B -9.08 -8.38 -8.15 32.96% CHEMBL249448
Levacetylmethadol ALDR_HUMAN aldo-keto reductase family 1 member B -6.36 -6.88 -6.43 33.33% CHEMBL319244
Rofecoxib ALDR_HUMAN aldo-keto reductase family 1 member B -8.47 -8.73 -8.55 53.47% CHEMBL319244
Amantadine AMPN_HUMAN alanyl aminopeptidase, membrane -5.97 -5.38 -5.19 38.24% CHEMBL27519
Alfentanil AMPN_HUMAN alanyl aminopeptidase, membrane -7.96 -8.07 -7.95 38.10% CHEMBL328470
Pimecrolimus AMPN_HUMAN alanyl aminopeptidase, membrane -8.48 -9.78 -8.76 33.33% CHEMBL28650
Levacetylmethadol AMPN_HUMAN alanyl aminopeptidase, membrane -7.60 -7.20 -7.93 39.00% CHEMBL1821978
Rofecoxib AMPN_HUMAN alanyl aminopeptidase, membrane -7.94 -8.98 -8.15 25.58% CHEMBL1782887
Amantadine AOFA_HUMAN monoamine oxidase A -6.77 -7.06 -6.96 25.53% CHEMBL3605361
Alfentanil AOFA_HUMAN monoamine oxidase A -8.53 -8.49 -8.88 37.44% CHEMBL394864
Pimecrolimus AOFA_HUMAN monoamine oxidase A -4.78 3.24 36.97 27.45% CHEMBL1629810
Levacetylmethadol AOFA_HUMAN monoamine oxidase A -7.44 -6.87 -6.68 51.35% CHEMBL3330339
Rofecoxib AOFA_HUMAN monoamine oxidase A -9.34 -9.92 -9.20 44.00% CHEMBL332223
Amantadine AOFB_HUMAN monoamine oxidase B -6.87 -6.95 -7.31 25.53% CHEMBL3605359
Alfentanil AOFB_HUMAN monoamine oxidase B -9.57 -8.75 -8.72 31.33% CHEMBL3781329
Pimecrolimus AOFB_HUMAN monoamine oxidase B 25.18 33.38 39.89 28.44% CHEMBL4062286
Levacetylmethadol AOFB_HUMAN monoamine oxidase B -8.38 -7.22 -8.10 51.35% CHEMBL3330339
Rofecoxib AOFB_HUMAN monoamine oxidase B -9.89 -10.26 -10.74 44.72% CHEMBL1254624
Amantadine BACE1_HUMAN beta-secretase 1 -5.04 -5.07 -5.50 26.00% CHEMBL583178
Alfentanil BACE1_HUMAN beta-secretase 1 -6.77 -6.97 -7.51 46.43% CHEMBL1645517
Pimecrolimus BACE1_HUMAN beta-secretase 1 -9.21 -9.26 -8.97 46.97% CHEMBL508218
Levacetylmethadol BACE1_HUMAN beta-secretase 1 -6.11 -6.48 -6.99 45.92% CHEMBL1092504
Rofecoxib BACE1_HUMAN beta-secretase 1 -6.82 -7.88 -8.53 37.93% CHEMBL3677230
Amantadine CAH2_HUMAN carbonic anhydrase 2 -4.92 -4.75 -4.20 46.43% CHEMBL355555
Alfentanil CAH2_HUMAN carbonic anhydrase 2 -7.34 -6.93 -6.84 37.67% CHEMBL183450
Pimecrolimus CAH2_HUMAN carbonic anhydrase 2 -7.36 -7.85 -6.99 39.68% CHEMBL170725
Levacetylmethadol CAH2_HUMAN carbonic anhydrase 2 -6.55 -6.49 -6.45 44.21% CHEMBL419006
Rofecoxib CAH2_HUMAN carbonic anhydrase 2 -6.93 -8.39 -8.27 50.00% CHEMBL419006
Amantadine CASP1_HUMAN caspase 1 -4.61 -4.84 -5.77 16.44% CHEMBL466565
Alfentanil CASP1_HUMAN caspase 1 -5.81 -6.47 -5.96 42.21% CHEMBL322631
Pimecrolimus CASP1_HUMAN caspase 1 -6.88 -7.18 -7.27 47.31% CHEMBL198845
Levacetylmethadol CASP1_HUMAN caspase 1 -4.95 -6.98 -5.52 48.94% CHEMBL466565
Rofecoxib CASP1_HUMAN caspase 1 -6.21 -7.26 -5.91 30.34% CHEMBL1222686
Amantadine CDK5_HUMAN cyclin dependent kinase 5 -6.86 -6.80 -5.52 23.64% CHEMBL1994526
Alfentanil CDK5_HUMAN cyclin dependent kinase 5 -6.72 -6.46 -6.64 30.00% CHEMBL1988141
Pimecrolimus CDK5_HUMAN cyclin dependent kinase 5 -8.03 -8.51 -4.99 28.88% CHEMBL1980995
Levacetylmethadol CDK5_HUMAN cyclin dependent kinase 5 -5.76 -4.74 -5.38 44.57% CHEMBL1988201
Rofecoxib CDK5_HUMAN cyclin dependent kinase 5 -8.15 -9.21 -8.58 29.14% CHEMBL1996176
Amantadine CHLE_HUMAN butyrylcholinesterase -6.08 -5.88 -6.08 68.42% CHEMBL498645
Alfentanil CHLE_HUMAN butyrylcholinesterase -7.91 -8.44 -7.94 38.06% CHEMBL4060562
Pimecrolimus CHLE_HUMAN butyrylcholinesterase -5.30 -2.03 -9.49 41.28% CHEMBL4079599
Levacetylmethadol CHLE_HUMAN butyrylcholinesterase -8.29 -8.13 -8.68 43.75% CHEMBL603913
Rofecoxib CHLE_HUMAN butyrylcholinesterase -10.03 -9.25 -8.93 37.50% CHEMBL492233
Amantadine CNR1_HUMAN cannabinoid receptor 1 -5.83 -6.25 -6.59 26.67% CHEMBL483143
Alfentanil CNR1_HUMAN cannabinoid receptor 1 -7.72 -9.03 -8.12 39.57% CHEMBL199873
Pimecrolimus CNR1_HUMAN cannabinoid receptor 1 -6.73 -5.75 -6.81 45.45% CHEMBL3597330
Levacetylmethadol CNR1_HUMAN cannabinoid receptor 1 -5.97 -7.75 -5.43 45.92% CHEMBL3321781
Rofecoxib CNR1_HUMAN cannabinoid receptor 1 -9.01 -9.40 -10.20 33.80% CHEMBL361957
Amantadine CNR2_HUMAN cannabinoid receptor 2 -6.49 -6.81 N/A 28.89% CHEMBL1422818
Alfentanil CNR2_HUMAN cannabinoid receptor 2 -8.04 -8.77 N/A 39.61% CHEMBL1762292
Pimecrolimus CNR2_HUMAN cannabinoid receptor 2 13.48 10.87 N/A 45.16% CHEMBL3597331
Levacetylmethadol CNR2_HUMAN cannabinoid receptor 2 -8.23 -8.01 N/A 49.47% CHEMBL1765274
Rofecoxib CNR2_HUMAN cannabinoid receptor 2 -9.73 -9.51 N/A 33.11% CHEMBL3410820
Amantadine COLI_HUMAN proopiomelanocortin -6.50 -6.27 -4.87 N/A N/A
Alfentanil COLI_HUMAN proopiomelanocortin -7.52 -7.68 -6.83 N/A N/A
Pimecrolimus COLI_HUMAN proopiomelanocortin -7.08 -7.65 -7.78 N/A N/A
Levacetylmethadol COLI_HUMAN proopiomelanocortin -6.92 -6.38 -6.09 N/A N/A
Rofecoxib COLI_HUMAN proopiomelanocortin -9.17 -9.06 -7.70 N/A N/A
Amantadine COMT_HUMAN catechol-O-methyltransferase -3.93 -5.43 -3.96 9.43% CHEMBL3425731
Alfentanil COMT_HUMAN catechol-O-methyltransferase -5.52 -6.06 -5.47 25.59% CHEMBL3819488
Pimecrolimus COMT_HUMAN catechol-O-methyltransferase -6.32 -8.01 -3.67 26.62% CHEMBL3819488
Levacetylmethadol COMT_HUMAN catechol-O-methyltransferase -5.51 -5.52 -5.74 28.57% CHEMBL3425731
Rofecoxib COMT_HUMAN catechol-O-methyltransferase -7.03 -6.27 -7.22 21.66% CHEMBL953
Amantadine CRP_HUMAN C-reactive protein -4.54 -4.59 N/A N/A N/A
Alfentanil CRP_HUMAN C-reactive protein -5.35 -5.48 N/A N/A N/A
Pimecrolimus CRP_HUMAN C-reactive protein -5.59 -6.48 N/A N/A N/A
Levacetylmethadol CRP_HUMAN C-reactive protein -5.14 -4.71 N/A N/A N/A
Rofecoxib CRP_HUMAN C-reactive protein -6.35 -6.23 N/A N/A N/A
Amantadine CXCR1_HUMAN C-X-C motif chemokine receptor 1 -6.74 N/A N/A 9.23% CHEMBL191413
Alfentanil CXCR1_HUMAN C-X-C motif chemokine receptor 1 -4.35 N/A N/A 29.73% CHEMBL3701188
Pimecrolimus CXCR1_HUMAN C-X-C motif chemokine receptor 1 97.35 N/A N/A 25.94% CHEMBL3701188
Levacetylmethadol CXCR1_HUMAN C-X-C motif chemokine receptor 1 -5.19 N/A N/A 27.27% CHEMBL191413
Rofecoxib CXCR1_HUMAN C-X-C motif chemokine receptor 1 -6.39 N/A N/A 26.09% CHEMBL191413
Amantadine CXCR4_HUMAN C-X-C motif chemokine receptor 4 -5.86 -4.26 -5.16 21.57% CHEMBL2170299
Alfentanil CXCR4_HUMAN C-X-C motif chemokine receptor 4 -8.23 -6.86 -7.36 31.77% CHEMBL3893083
Pimecrolimus CXCR4_HUMAN C-X-C motif chemokine receptor 4 -9.63 -8.56 -10.26 48.03% CHEMBL1221944
Levacetylmethadol CXCR4_HUMAN C-X-C motif chemokine receptor 4 -7.59 -6.00 -6.87 34.62% CHEMBL366033
Rofecoxib CXCR4_HUMAN C-X-C motif chemokine receptor 4 -8.63 -6.90 -7.70 27.13% CHEMBL126657
Amantadine DRD2_HUMAN dopamine receptor D2 -6.40 N/A N/A 23.64% CHEMBL78916
Alfentanil DRD2_HUMAN dopamine receptor D2 -7.37 N/A N/A 45.45% CHEMBL1242923
Pimecrolimus DRD2_HUMAN dopamine receptor D2 -8.88 N/A N/A 35.95% CHEMBL1909065
Levacetylmethadol DRD2_HUMAN dopamine receptor D2 -6.87 N/A N/A 52.53% CHEMBL2308105
Rofecoxib DRD2_HUMAN dopamine receptor D2 -8.01 N/A N/A 38.89% CHEMBL2368629
Amantadine DRD3_HUMAN dopamine receptor D3 -6.04 N/A N/A 26.53% CHEMBL165381
Alfentanil DRD3_HUMAN dopamine receptor D3 -7.42 N/A N/A 40.14% CHEMBL3354072
Pimecrolimus DRD3_HUMAN dopamine receptor D3 3.59 N/A N/A 48.33% CHEMBL1200633
Levacetylmethadol DRD3_HUMAN dopamine receptor D3 -6.15 N/A N/A 56.41% CHEMBL936
Rofecoxib DRD3_HUMAN dopamine receptor D3 -9.52 N/A N/A 38.89% CHEMBL2368629
Amantadine DRD4_HUMAN dopamine receptor D4 -6.28 -6.20 N/A 20.69% CHEMBL1242950
Alfentanil DRD4_HUMAN dopamine receptor D4 -8.52 -8.60 N/A 40.14% CHEMBL3354072
Pimecrolimus DRD4_HUMAN dopamine receptor D4 -2.96 -4.81 N/A 33.88% CHEMBL282927
Levacetylmethadol DRD4_HUMAN dopamine receptor D4 -6.98 -6.70 N/A 52.53% CHEMBL2308105
Rofecoxib DRD4_HUMAN dopamine receptor D4 -8.49 -8.43 N/A 29.11% CHEMBL69759
Amantadine EDN1_HUMAN endothelin 1 -5.96 N/A N/A N/A N/A
Alfentanil EDN1_HUMAN endothelin 1 -7.78 N/A N/A N/A N/A
Pimecrolimus EDN1_HUMAN endothelin 1 -9.70 N/A N/A N/A N/A
Levacetylmethadol EDN1_HUMAN endothelin 1 -6.35 N/A N/A N/A N/A
Rofecoxib EDN1_HUMAN endothelin 1 -7.64 N/A N/A N/A N/A
Amantadine ESR1_HUMAN estrogen receptor 1 -5.90 -5.61 -5.58 21.21% CHEMBL1200623
Alfentanil ESR1_HUMAN estrogen receptor 1 -7.83 -7.59 -7.77 36.59% CHEMBL1475062
Pimecrolimus ESR1_HUMAN estrogen receptor 1 -5.54 -7.03 -6.40 37.02% CHEMBL4075710
Levacetylmethadol ESR1_HUMAN estrogen receptor 1 -6.93 -7.34 -8.17 44.00% CHEMBL1222035
Rofecoxib ESR1_HUMAN estrogen receptor 1 -8.76 -9.26 -9.38 43.80% CHEMBL3581689
Amantadine FABP5_HUMAN fatty acid binding protein 5 -5.45 -4.20 -4.65 23.08% CHEMBL82293
Alfentanil FABP5_HUMAN fatty acid binding protein 5 -8.03 -5.73 -5.76 29.00% CHEMBL3959018
Pimecrolimus FABP5_HUMAN fatty acid binding protein 5 8.86 -7.25 -7.23 22.76% CHEMBL3943278
Levacetylmethadol FABP5_HUMAN fatty acid binding protein 5 -8.03 -5.15 -5.20 23.20% CHEMBL212860
Rofecoxib FABP5_HUMAN fatty acid binding protein 5 -8.44 -6.22 -6.03 22.70% CHEMBL212860
Amantadine FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -6.25 N/A N/A 40.00% CHEMBL334255
Alfentanil FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -7.15 N/A N/A 34.56% CHEMBL407135
Pimecrolimus FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -8.14 N/A N/A 35.15% CHEMBL1221512
Levacetylmethadol FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -6.56 N/A N/A 46.46% CHEMBL305660
Rofecoxib FYN_HUMAN FYN proto-oncogene, Src family tyrosine kinase -9.04 N/A N/A 29.09% CHEMBL1221512
Amantadine GLRA3_HUMAN glycine receptor alpha 3 -5.92 -5.94 -5.95 4.64% CHEMBL4070615
Amantadine GLRA3_HUMAN glycine receptor alpha 3 -7.26 N/A N/A 4.64% CHEMBL4070615
Alfentanil GLRA3_HUMAN glycine receptor alpha 3 -7.82 -7.83 -7.56 24.08% CHEMBL4070615
Alfentanil GLRA3_HUMAN glycine receptor alpha 3 -8.90 N/A N/A 24.08% CHEMBL4070615
Pimecrolimus GLRA3_HUMAN glycine receptor alpha 3 -7.67 -6.64 -7.26 19.93% CHEMBL4070615
Pimecrolimus GLRA3_HUMAN glycine receptor alpha 3 -6.80 N/A N/A 19.93% CHEMBL4070615
Levacetylmethadol GLRA3_HUMAN glycine receptor alpha 3 -7.55 -7.00 -7.00 17.81% CHEMBL4070615
Levacetylmethadol GLRA3_HUMAN glycine receptor alpha 3 -8.14 N/A N/A 17.81% CHEMBL4070615
Rofecoxib GLRA3_HUMAN glycine receptor alpha 3 -8.90 -9.16 -8.83 19.40% CHEMBL4070615
Rofecoxib GLRA3_HUMAN glycine receptor alpha 3 -9.56 N/A N/A 19.40% CHEMBL4070615
Amantadine GRM5_HUMAN glutamate metabotropic receptor 5 -6.87 -4.63 -4.89 38.24% CHEMBL1783985
Alfentanil GRM5_HUMAN glutamate metabotropic receptor 5 -6.93 -6.31 -6.10 40.12% CHEMBL3939327
Pimecrolimus GRM5_HUMAN glutamate metabotropic receptor 5 65.78 77.47 69.91 30.77% CHEMBL3086720
Levacetylmethadol GRM5_HUMAN glutamate metabotropic receptor 5 -4.55 -1.44 -1.18 42.59% CHEMBL92162
Rofecoxib GRM5_HUMAN glutamate metabotropic receptor 5 -8.77 -8.64 -7.93 32.06% CHEMBL92162
Amantadine HPGDS_HUMAN hematopoietic prostaglandin D synthase -5.46 -4.46 -5.44 11.54% CHEMBL3134492
Alfentanil HPGDS_HUMAN hematopoietic prostaglandin D synthase -6.76 -6.72 -6.86 41.52% CHEMBL3425956
Pimecrolimus HPGDS_HUMAN hematopoietic prostaglandin D synthase -7.75 -8.37 -6.92 25.24% CHEMBL3650224
Levacetylmethadol HPGDS_HUMAN hematopoietic prostaglandin D synthase -6.95 -6.17 -6.10 25.29% CHEMBL3698265
Rofecoxib HPGDS_HUMAN hematopoietic prostaglandin D synthase -7.86 -7.60 -6.88 24.08% CHEMBL572528
Amantadine HRH1_HUMAN histamine receptor H1 -5.20 N/A N/A 22.41% CHEMBL571174
Alfentanil HRH1_HUMAN histamine receptor H1 -6.43 N/A N/A 45.45% CHEMBL1242923
Pimecrolimus HRH1_HUMAN histamine receptor H1 68.56 N/A N/A 31.02% CHEMBL1278112
Levacetylmethadol HRH1_HUMAN histamine receptor H1 -3.67 N/A N/A 59.52% CHEMBL914
Rofecoxib HRH1_HUMAN histamine receptor H1 -7.85 N/A N/A 31.11% CHEMBL908
Amantadine HYES_HUMAN epoxide hydrolase 2 -6.05 -6.79 -6.50 39.39% CHEMBL69663
Alfentanil HYES_HUMAN epoxide hydrolase 2 -7.98 -7.98 -8.01 42.25% CHEMBL549576
Pimecrolimus HYES_HUMAN epoxide hydrolase 2 -8.61 -2.61 -8.71 42.00% CHEMBL561665
Levacetylmethadol HYES_HUMAN epoxide hydrolase 2 -7.71 -6.79 -7.38 53.27% CHEMBL2070334
Rofecoxib HYES_HUMAN epoxide hydrolase 2 -9.99 -8.65 -8.33 45.00% CHEMBL4071682
Amantadine IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -4.92 N/A N/A 15.38% CHEMBL1762621
Alfentanil IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -5.83 N/A N/A 34.62% CHEMBL2208034
Pimecrolimus IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -7.08 N/A N/A 48.98% CHEMBL1672879
Levacetylmethadol IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -4.93 N/A N/A 33.02% CHEMBL1253688
Rofecoxib IKKB_HUMAN inhibitor of nuclear factor kappa B kinase subunit beta -9.33 N/A N/A 38.71% CHEMBL3114503
Amantadine MDR1_HUMAN ATP binding cassette subfamily B member 1 -5.69 -6.23 N/A 57.14% CHEMBL448741
Alfentanil MDR1_HUMAN ATP binding cassette subfamily B member 1 -7.61 -7.38 N/A 38.46% CHEMBL1008
Pimecrolimus MDR1_HUMAN ATP binding cassette subfamily B member 1 -10.78 -9.96 N/A 92.67% CHEMBL269732
Levacetylmethadol MDR1_HUMAN ATP binding cassette subfamily B member 1 -7.14 -6.63 N/A 59.52% CHEMBL914
Rofecoxib MDR1_HUMAN ATP binding cassette subfamily B member 1 -8.53 -9.01 N/A 41.73% CHEMBL2336636
Amantadine MIF_HUMAN macrophage migration inhibitory factor -4.40 -6.37 -5.60 11.54% CHEMBL233248
Alfentanil MIF_HUMAN macrophage migration inhibitory factor -6.67 -6.89 -5.50 23.50% CHEMBL554271
Pimecrolimus MIF_HUMAN macrophage migration inhibitory factor 55.31 -6.60 -5.75 31.32% CHEMBL2375651
Levacetylmethadol MIF_HUMAN macrophage migration inhibitory factor -5.59 -6.23 -5.95 31.39% CHEMBL497598
Rofecoxib MIF_HUMAN macrophage migration inhibitory factor -7.24 -8.50 -6.69 23.89% CHEMBL3409229
Amantadine MK01_HUMAN mitogen-activated protein kinase 1 -4.87 -5.30 -6.03 12.77% CHEMBL547
Alfentanil MK01_HUMAN mitogen-activated protein kinase 1 -6.36 -7.08 -7.23 38.67% CHEMBL3398602
Pimecrolimus MK01_HUMAN mitogen-activated protein kinase 1 -7.32 -7.60 -4.79 33.46% CHEMBL555017
Levacetylmethadol MK01_HUMAN mitogen-activated protein kinase 1 -5.05 -6.16 -6.52 38.46% CHEMBL3752989
Rofecoxib MK01_HUMAN mitogen-activated protein kinase 1 -8.60 -8.14 -7.20 53.47% CHEMBL319244
Amantadine MK03_HUMAN mitogen-activated protein kinase 3 -5.67 -5.41 -5.59 12.50% CHEMBL3113587
Alfentanil MK03_HUMAN mitogen-activated protein kinase 3 -6.87 -6.72 -7.54 30.65% CHEMBL3590107
Pimecrolimus MK03_HUMAN mitogen-activated protein kinase 3 -6.48 -8.41 -8.32 33.46% CHEMBL555017
Levacetylmethadol MK03_HUMAN mitogen-activated protein kinase 3 -5.40 -5.71 -5.74 31.45% CHEMBL3113587
Rofecoxib MK03_HUMAN mitogen-activated protein kinase 3 -8.84 -8.77 -8.14 24.00% CHEMBL555017
Amantadine MTOR_HUMAN mechanistic target of rapamycin kinase -6.55 -6.40 -6.35 18.57% CHEMBL3972399
Alfentanil MTOR_HUMAN mechanistic target of rapamycin kinase -9.17 -8.56 -8.64 40.76% CHEMBL411735
Pimecrolimus MTOR_HUMAN mechanistic target of rapamycin kinase -8.96 -8.89 -8.17 92.67% CHEMBL269732
Levacetylmethadol MTOR_HUMAN mechanistic target of rapamycin kinase -9.00 -9.08 -8.13 40.82% CHEMBL3972399
Rofecoxib MTOR_HUMAN mechanistic target of rapamycin kinase -9.40 -9.45 -9.19 27.16% CHEMBL3701064
Amantadine NEP_HUMAN membrane metalloendopeptidase -5.52 -6.01 -6.46 28.89% CHEMBL211529
Alfentanil NEP_HUMAN membrane metalloendopeptidase -6.57 -6.88 -7.58 37.97% CHEMBL51389
Pimecrolimus NEP_HUMAN membrane metalloendopeptidase -8.94 -8.55 -8.13 40.40% CHEMBL434492
Levacetylmethadol NEP_HUMAN membrane metalloendopeptidase -6.19 -5.94 -5.80 53.93% CHEMBL213404
Rofecoxib NEP_HUMAN membrane metalloendopeptidase -7.82 -7.62 -7.21 31.20% CHEMBL81232
Amantadine NK1R_HUMAN tachykinin receptor 1 -6.39 -6.68 -5.59 20.69% CHEMBL143813
Alfentanil NK1R_HUMAN tachykinin receptor 1 -8.49 -7.61 -7.56 45.83% CHEMBL2313628
Pimecrolimus NK1R_HUMAN tachykinin receptor 1 -8.78 -9.64 -9.74 41.49% CHEMBL538131
Levacetylmethadol NK1R_HUMAN tachykinin receptor 1 -8.21 -6.30 -6.50 65.22% CHEMBL209531
Rofecoxib NK1R_HUMAN tachykinin receptor 1 -8.91 -9.40 -9.00 30.81% CHEMBL93184
Amantadine NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -6.00 -5.92 -6.05 7.59% CHEMBL284237
Alfentanil NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -7.75 -6.97 -7.19 13.41% CHEMBL284237
Pimecrolimus NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -9.33 -7.74 -8.94 13.24% CHEMBL2333945
Levacetylmethadol NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -6.47 -6.68 -6.07 29.63% CHEMBL284237
Rofecoxib NMDE1_HUMAN glutamate ionotropic receptor NMDA type subunit 2A -10.09 -9.70 -10.02 18.99% CHEMBL2333945
Amantadine NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -5.32 -6.40 -4.57 24.07% CHEMBL3357791
Alfentanil NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -8.33 -9.32 -6.34 30.25% CHEMBL218017
Pimecrolimus NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -0.95 15.23 -6.50 21.71% CHEMBL17350
Levacetylmethadol NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -6.53 -8.52 -5.69 48.78% CHEMBL3357791
Rofecoxib NMDE2_HUMAN glutamate ionotropic receptor NMDA type subunit 2B -9.75 -9.01 -9.61 24.80% CHEMBL151174
Amantadine NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -5.93 -5.86 -6.05 8.74% CHEMBL419399
Alfentanil NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -7.03 -7.57 -7.19 28.84% CHEMBL399075
Pimecrolimus NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -9.52 -7.75 -8.94 23.02% CHEMBL399075
Levacetylmethadol NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -6.53 -6.70 -6.07 31.50% CHEMBL419399
Rofecoxib NMDZ1_HUMAN glutamate ionotropic receptor NMDA type subunit 1 -9.15 -9.92 -10.02 18.59% CHEMBL401253
Amantadine NOS1_HUMAN nitric oxide synthase 1 -6.49 -6.22 -5.75 31.71% CHEMBL185441
Alfentanil NOS1_HUMAN nitric oxide synthase 1 -7.02 -7.10 -7.45 35.71% CHEMBL317521
Pimecrolimus NOS1_HUMAN nitric oxide synthase 1 -10.00 -10.09 -8.63 29.57% CHEMBL1270460
Levacetylmethadol NOS1_HUMAN nitric oxide synthase 1 -6.44 -6.39 -7.47 39.66% CHEMBL1270460
Rofecoxib NOS1_HUMAN nitric oxide synthase 1 -8.67 -8.50 -9.05 22.15% CHEMBL315966
Amantadine NOS2_HUMAN nitric oxide synthase 2 -5.64 -5.27 -5.53 45.00% CHEMBL1783072
Alfentanil NOS2_HUMAN nitric oxide synthase 2 -6.38 -7.35 -6.15 35.62% CHEMBL112747
Pimecrolimus NOS2_HUMAN nitric oxide synthase 2 83.13 -6.40 ? ? ?
Levacetylmethadol NOS2_HUMAN nitric oxide synthase 2 -5.07 -6.22 -7.54 33.33% CHEMBL1762476
Rofecoxib NOS2_HUMAN nitric oxide synthase 2 -8.03 -8.57 -8.84 29.58% CHEMBL1762474
Amantadine NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -5.62 -5.87 -5.71 13.48% CHEMBL1982413
Alfentanil NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -7.09 -7.17 -7.09 35.96% CHEMBL3934925
Pimecrolimus NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -7.83 -7.52 -7.01 33.33% CHEMBL444109
Levacetylmethadol NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -5.98 -7.08 -6.39 30.25% CHEMBL3912980
Rofecoxib NTRK1_HUMAN neurotrophic receptor tyrosine kinase 1 -10.36 -9.51 -9.77 29.94% CHEMBL1794059
Amantadine OPRD_HUMAN opioid receptor delta 1 -5.49 -4.82 -4.75 25.00% CHEMBL2112342
Alfentanil OPRD_HUMAN opioid receptor delta 1 -7.48 -6.86 -7.26 60.84% CHEMBL169366
Pimecrolimus OPRD_HUMAN opioid receptor delta 1 -9.64 8.51 7.28 51.21% CHEMBL3597152
Levacetylmethadol OPRD_HUMAN opioid receptor delta 1 -6.64 -7.04 -6.63 56.82% CHEMBL290855
Rofecoxib OPRD_HUMAN opioid receptor delta 1 -8.59 -7.75 -7.53 34.59% CHEMBL129693
Amantadine OPRK_HUMAN opioid receptor kappa 1 -5.76 -6.32 -6.21 52.00% CHEMBL2432039
Alfentanil OPRK_HUMAN opioid receptor kappa 1 -8.79 -7.74 -7.73 59.84% CHEMBL609147
Pimecrolimus OPRK_HUMAN opioid receptor kappa 1 -8.32 -9.99 -7.10 51.21% CHEMBL3597152
Levacetylmethadol OPRK_HUMAN opioid receptor kappa 1 -7.63 -6.85 -6.98 66.67% CHEMBL2260849
Rofecoxib OPRK_HUMAN opioid receptor kappa 1 -8.76 -9.01 -7.85 37.69% CHEMBL279298
Amantadine OPRM_MOUSE Mu-type opioid receptor -6.50 -5.31 N/A 18.31% CHEMBL592
Alfentanil OPRM_MOUSE Mu-type opioid receptor -7.85 -7.95 N/A 54.68% CHEMBL2311157
Pimecrolimus OPRM_MOUSE Mu-type opioid receptor -9.24 -10.25 N/A 49.48% CHEMBL405663
Levacetylmethadol OPRM_MOUSE Mu-type opioid receptor -7.34 -6.96 N/A 45.71% CHEMBL440765
Rofecoxib OPRM_MOUSE Mu-type opioid receptor -8.36 -8.02 N/A 31.74% CHEMBL186041
Amantadine OPRX_HUMAN opioid related nociceptin receptor 1 -5.98 -5.58 -5.57 27.08% CHEMBL53256
Alfentanil OPRX_HUMAN opioid related nociceptin receptor 1 -6.99 -6.94 -7.15 54.68% CHEMBL28198
Pimecrolimus OPRX_HUMAN opioid related nociceptin receptor 1 -10.21 -9.49 -10.68 34.90% CHEMBL1783822
Levacetylmethadol OPRX_HUMAN opioid related nociceptin receptor 1 -6.86 -5.96 -7.06 58.76% CHEMBL364625
Rofecoxib OPRX_HUMAN opioid related nociceptin receptor 1 -8.11 -7.32 -7.53 30.08% CHEMBL364625
Amantadine P2RX3_HUMAN purinergic receptor P2X 3 -4.15 -3.91 -4.26 10.74% CHEMBL3674941
Alfentanil P2RX3_HUMAN purinergic receptor P2X 3 -5.65 -5.35 -5.29 38.89% CHEMBL3669852
Pimecrolimus P2RX3_HUMAN purinergic receptor P2X 3 -7.14 -6.29 -6.17 36.06% CHEMBL3669852
Levacetylmethadol P2RX3_HUMAN purinergic receptor P2X 3 -4.86 -4.71 -4.43 29.14% CHEMBL3669705
Rofecoxib P2RX3_HUMAN purinergic receptor P2X 3 -6.02 -5.98 -5.68 25.95% CHEMBL3669744
Amantadine P2Y12_HUMAN purinergic receptor P2Y12 -4.75 -4.46 -5.27 14.00% CHEMBL299895
Alfentanil P2Y12_HUMAN purinergic receptor P2Y12 -7.13 -2.60 -7.01 36.52% CHEMBL90804
Pimecrolimus P2Y12_HUMAN purinergic receptor P2Y12 -8.05 41.45 27.58 35.42% CHEMBL272975
Levacetylmethadol P2Y12_HUMAN purinergic receptor P2Y12 -6.16 -3.43 -4.28 36.43% CHEMBL88799
Rofecoxib P2Y12_HUMAN purinergic receptor P2Y12 -7.93 -7.13 -8.34 35.82% CHEMBL88730
Amantadine PAR1_HUMAN coagulation factor II thrombin receptor -6.09 N/A N/A 20.75% CHEMBL80672
Alfentanil PAR1_HUMAN coagulation factor II thrombin receptor -5.97 N/A N/A 43.33% CHEMBL3658403
Pimecrolimus PAR1_HUMAN coagulation factor II thrombin receptor -6.84 N/A N/A 38.16% CHEMBL3925032
Levacetylmethadol PAR1_HUMAN coagulation factor II thrombin receptor -8.49 N/A N/A 40.20% CHEMBL3658406
Rofecoxib PAR1_HUMAN coagulation factor II thrombin receptor -7.36 N/A N/A 29.05% CHEMBL197523
Amantadine PDE4B_HUMAN phosphodiesterase 4B -5.34 -5.28 -5.47 12.50% CHEMBL346083
Alfentanil PDE4B_HUMAN phosphodiesterase 4B -7.59 -8.23 -8.17 33.53% CHEMBL239299
Pimecrolimus PDE4B_HUMAN phosphodiesterase 4B -8.56 -8.65 -7.77 40.28% CHEMBL2063002
Levacetylmethadol PDE4B_HUMAN phosphodiesterase 4B -7.15 -6.68 -7.20 41.67% CHEMBL144499
Rofecoxib PDE4B_HUMAN phosphodiesterase 4B -9.04 -10.15 -10.10 59.52% CHEMBL197386
Amantadine PDE5A_HUMAN phosphodiesterase 5A -5.06 -6.15 -5.57 12.75% CHEMBL554946
Alfentanil PDE5A_HUMAN phosphodiesterase 5A -7.73 -8.27 -7.70 31.00% CHEMBL551948
Pimecrolimus PDE5A_HUMAN phosphodiesterase 5A -8.05 -8.61 -8.48 30.52% CHEMBL190364
Levacetylmethadol PDE5A_HUMAN phosphodiesterase 5A -6.99 -6.94 -6.99 29.93% CHEMBL190423
Rofecoxib PDE5A_HUMAN phosphodiesterase 5A -9.44 -9.93 -9.86 22.67% CHEMBL554051
Amantadine PERM_HUMAN myeloperoxidase -5.68 -5.97 -5.41 15.38% CHEMBL1630743
Alfentanil PERM_HUMAN myeloperoxidase -7.35 -7.35 -7.05 31.06% CHEMBL1409565
Pimecrolimus PERM_HUMAN myeloperoxidase -7.07 -8.79 -10.30 22.22% CHEMBL490
Levacetylmethadol PERM_HUMAN myeloperoxidase -7.33 -7.69 -7.62 37.08% CHEMBL3892909
Rofecoxib PERM_HUMAN myeloperoxidase -8.52 -8.77 -8.73 20.71% CHEMBL2347182
Amantadine PGH1_SHEEP Prostaglandin G/H synthase 1 -4.83 -6.02 -6.28 14.29% CHEMBL503071
Alfentanil PGH1_SHEEP Prostaglandin G/H synthase 1 -6.34 -7.57 -6.88 29.63% CHEMBL9197
Pimecrolimus PGH1_SHEEP Prostaglandin G/H synthase 1 46.79 39.86 39.11 50.91% CHEMBL502799
Levacetylmethadol PGH1_SHEEP Prostaglandin G/H synthase 1 -4.24 -5.21 -6.68 44.87% CHEMBL1945285
Rofecoxib PGH1_SHEEP Prostaglandin G/H synthase 1 -8.30 -8.83 -8.72 74.23% CHEMBL259402
Amantadine PGH2_HUMAN prostaglandin-endoperoxide synthase 2 -4.69 -4.93 -5.70 13.79% CHEMBL43864
Alfentanil PGH2_HUMAN prostaglandin-endoperoxide synthase 2 -3.17 -4.71 -6.64 31.61% CHEMBL3809156
Pimecrolimus PGH2_HUMAN prostaglandin-endoperoxide synthase 2 84.54 54.53 -1.06 50.30% CHEMBL206765
Levacetylmethadol PGH2_HUMAN prostaglandin-endoperoxide synthase 2 0.14 -5.26 -5.43 47.44% CHEMBL441414
Rofecoxib PGH2_HUMAN prostaglandin-endoperoxide synthase 2 -6.38 -7.55 -7.52 100.00% CHEMBL122
Amantadine PPAP_HUMAN acid phosphatase 3 -6.42 N/A N/A 5.33% CHEMBL501717
Alfentanil PPAP_HUMAN acid phosphatase 3 -6.85 N/A N/A 13.45% CHEMBL507996
Pimecrolimus PPAP_HUMAN acid phosphatase 3 -7.65 N/A N/A 11.82% CHEMBL507996
Levacetylmethadol PPAP_HUMAN acid phosphatase 3 -7.37 N/A N/A 19.64% CHEMBL501717
Rofecoxib PPAP_HUMAN acid phosphatase 3 -8.11 N/A N/A 14.38% CHEMBL507996
Amantadine PPARG_HUMAN peroxisome proliferator activated receptor gamma -4.64 -4.93 -4.88 22.03% CHEMBL1836976
Alfentanil PPARG_HUMAN peroxisome proliferator activated receptor gamma -7.14 -7.37 -7.57 40.46% CHEMBL177854
Pimecrolimus PPARG_HUMAN peroxisome proliferator activated receptor gamma -8.07 -6.10 -7.73 49.07% CHEMBL1834952
Levacetylmethadol PPARG_HUMAN peroxisome proliferator activated receptor gamma -5.82 -6.46 -6.66 47.06% CHEMBL396109
Rofecoxib PPARG_HUMAN peroxisome proliferator activated receptor gamma -7.87 -9.34 -8.76 43.09% CHEMBL144112
Amantadine PRGR_HUMAN progesterone receptor -6.32 -6.04 -5.89 18.92% CHEMBL1684464
Alfentanil PRGR_HUMAN progesterone receptor -7.26 -6.73 -8.96 38.65% CHEMBL600466
Pimecrolimus PRGR_HUMAN progesterone receptor 57.13 57.06 28.66 41.10% CHEMBL1370
Levacetylmethadol PRGR_HUMAN progesterone receptor -5.95 -7.00 -8.86 39.23% CHEMBL197161
Rofecoxib PRGR_HUMAN progesterone receptor -8.31 -7.77 -8.68 37.79% CHEMBL2419306
Amantadine PTGES_HUMAN prostaglandin E synthase -5.77 N/A N/A 16.88% CHEMBL3919693
Alfentanil PTGES_HUMAN prostaglandin E synthase -6.83 N/A N/A 46.75% CHEMBL3910746
Pimecrolimus PTGES_HUMAN prostaglandin E synthase -6.58 N/A N/A 31.82% CHEMBL2315862
Levacetylmethadol PTGES_HUMAN prostaglandin E synthase -5.96 N/A N/A 35.51% CHEMBL3919693
Rofecoxib PTGES_HUMAN prostaglandin E synthase -7.06 N/A N/A 39.04% CHEMBL2071516
Amantadine SC6A4_HUMAN solute carrier family 6 member 4 -6.14 -6.09 -6.42 40.00% CHEMBL334255
Alfentanil SC6A4_HUMAN solute carrier family 6 member 4 -8.85 -8.71 -8.89 44.97% CHEMBL91418
Pimecrolimus SC6A4_HUMAN solute carrier family 6 member 4 4.85 -2.22 15.51 37.36% CHEMBL86590
Levacetylmethadol SC6A4_HUMAN solute carrier family 6 member 4 -8.19 -7.98 -8.02 63.33% CHEMBL598644
Rofecoxib SC6A4_HUMAN solute carrier family 6 member 4 -9.90 -9.92 -10.16 39.85% CHEMBL574543
Amantadine SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.83 N/A N/A 16.92% CHEMBL2152692
Alfentanil SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.44 N/A N/A 36.45% CHEMBL2296310
Pimecrolimus SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.96 N/A N/A 32.64% CHEMBL507974
Levacetylmethadol SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -6.01 N/A N/A 43.64% CHEMBL206431
Rofecoxib SCN9A_HUMAN sodium voltage-gated channel alpha subunit 9 -7.67 N/A N/A 28.02% CHEMBL3682712
Amantadine TLR4_HUMAN toll like receptor 4 -7.14 -7.21 -5.91 13.75% CHEMBL1223752
Alfentanil TLR4_HUMAN toll like receptor 4 -7.04 -7.27 -7.39 35.21% CHEMBL1223752
Pimecrolimus TLR4_HUMAN toll like receptor 4 -8.84 -9.15 -9.18 51.47% CHEMBL2364541
Levacetylmethadol TLR4_HUMAN toll like receptor 4 -7.39 -7.09 -7.31 38.57% CHEMBL382272
Rofecoxib TLR4_HUMAN toll like receptor 4 -8.30 -7.21 -8.77 33.78% CHEMBL4071705
Amantadine TNFA_HUMAN tumor necrosis factor -5.83 N/A N/A 12.15% CHEMBL3944621
Alfentanil TNFA_HUMAN tumor necrosis factor -7.59 N/A N/A 32.28% CHEMBL3806296
Pimecrolimus TNFA_HUMAN tumor necrosis factor -8.65 N/A N/A 37.56% CHEMBL3983488
Levacetylmethadol TNFA_HUMAN tumor necrosis factor -7.12 N/A N/A 35.33% CHEMBL3983488
Rofecoxib TNFA_HUMAN tumor necrosis factor -8.24 N/A N/A 25.00% CHEMBL2337619
Amantadine TRBM_HUMAN thrombomodulin -4.91 -4.66 N/A N/A N/A
Alfentanil TRBM_HUMAN thrombomodulin -7.35 -6.98 N/A N/A N/A
Pimecrolimus TRBM_HUMAN thrombomodulin -7.97 -7.40 N/A N/A N/A
Levacetylmethadol TRBM_HUMAN thrombomodulin -6.67 -5.84 N/A N/A N/A
Rofecoxib TRBM_HUMAN thrombomodulin -7.67 -7.40 N/A N/A N/A
Amantadine TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -5.40 -5.24 N/A N/A N/A
Alfentanil TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -6.36 -6.94 N/A N/A N/A
Pimecrolimus TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -9.07 -7.14 N/A N/A N/A
Levacetylmethadol TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -6.38 -6.25 N/A N/A N/A
Rofecoxib TRPM4_HUMAN transient receptor potential cation channel subfamily M member 4 -7.06 -7.41 N/A N/A N/A
Amantadine TRPM8_FICAL Uncharacterized protein -6.19 N/A N/A N/A N/A
Alfentanil TRPM8_FICAL Uncharacterized protein -8.73 N/A N/A N/A N/A
Pimecrolimus TRPM8_FICAL Uncharacterized protein -6.47 N/A N/A N/A N/A
Levacetylmethadol TRPM8_FICAL Uncharacterized protein -7.94 N/A N/A N/A N/A
Rofecoxib TRPM8_FICAL Uncharacterized protein -9.19 N/A N/A N/A N/A
Amantadine TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -6.08 N/A N/A 18.52% CHEMBL15848
Alfentanil TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -7.72 N/A N/A 30.61% CHEMBL1395445
Pimecrolimus TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -8.83 N/A N/A 43.22% CHEMBL455555
Levacetylmethadol TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -6.75 N/A N/A 43.36% CHEMBL101775
Rofecoxib TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 -8.37 N/A N/A 35.67% CHEMBL319078
Amantadine TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -6.04 -6.27 N/A N/A N/A
Alfentanil TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -6.88 -7.86 N/A N/A N/A
Pimecrolimus TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -7.39 -8.97 N/A N/A N/A
Levacetylmethadol TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -5.79 -6.79 N/A N/A N/A
Rofecoxib TRPV2_RABIT Transient receptor potential cation channel subfamily V member 2 -8.78 -6.60 N/A N/A N/A
Amantadine TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -5.88 -5.89 N/A 10.83% CHEMBL3692292
Alfentanil TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -6.96 -6.64 N/A 26.06% CHEMBL3692258
Pimecrolimus TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -7.58 -6.16 N/A 26.03% CHEMBL3664218
Levacetylmethadol TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -6.66 -5.04 N/A 34.01% CHEMBL3664218
Rofecoxib TRPV3_HUMAN transient receptor potential cation channel subfamily V member 3 -6.71 -7.53 N/A 25.00% CHEMBL3696375
Amantadine TRXR1_HUMAN thioredoxin reductase 1 -5.81 -5.37 -4.57 N/A N/A
Alfentanil TRXR1_HUMAN thioredoxin reductase 1 -7.66 -7.69 -6.21 N/A N/A
Pimecrolimus TRXR1_HUMAN thioredoxin reductase 1 -7.55 -8.81 -9.39 N/A N/A
Levacetylmethadol TRXR1_HUMAN thioredoxin reductase 1 -7.10 -6.40 -5.82 N/A N/A
Rofecoxib TRXR1_HUMAN thioredoxin reductase 1 -7.86 -7.48 -6.65 N/A N/A
Amantadine TRY1_HUMAN serine protease 1 -4.56 N/A N/A 25.49% CHEMBL289395
Alfentanil TRY1_HUMAN serine protease 1 -6.36 N/A N/A 37.11% CHEMBL421370
Pimecrolimus TRY1_HUMAN serine protease 1 -6.43 N/A N/A 39.05% CHEMBL309670
Levacetylmethadol TRY1_HUMAN serine protease 1 -5.08 N/A N/A 50.00% CHEMBL102081
Rofecoxib TRY1_HUMAN serine protease 1 -6.97 N/A N/A 31.52% CHEMBL99629