Detailed information for compound 274117

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 321.373 | Formula: C19H19N3O2
  • H donors: 1 H acceptors: 2 LogP: 2.09 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1ccc2c3c1cccc3c(=O)n(c2=O)[C@H]1CN2CCC1CC2
  • InChi: 1S/C19H19N3O2/c20-15-5-4-14-17-12(15)2-1-3-13(17)18(23)22(19(14)24)16-10-21-8-6-11(16)7-9-21/h1-5,11,16H,6-10,20H2/t16-/m0/s1
  • InChiKey: GGQMXMGHFNPCQV-INIZCTEOSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Serotonin 3 (5-HT3) receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma japonicum Neuronal acetylcholine receptor subunit alpha-9-II precursor, putative Serotonin 3 (5-HT3) receptor   483 aa 457 aa 24.7 %
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit Serotonin 3 (5-HT3) receptor   483 aa 457 aa 26.7 %
Onchocerca volvulus Large subunit GTPase 1 homolog Serotonin 3 (5-HT3) receptor   483 aa 394 aa 19.3 %
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit Serotonin 3 (5-HT3) receptor   483 aa 470 aa 26.8 %
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative Serotonin 3 (5-HT3) receptor   483 aa 514 aa 23.2 %
Onchocerca volvulus Serotonin 3 (5-HT3) receptor   483 aa 461 aa 24.3 %
Brugia malayi acetylcholine receptor alpha subunit precursor, putative Serotonin 3 (5-HT3) receptor   483 aa 463 aa 26.8 %
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit Serotonin 3 (5-HT3) receptor   483 aa 445 aa 25.4 %
Onchocerca volvulus Acetylcholine receptor subunit alpha-type homolog Serotonin 3 (5-HT3) receptor   483 aa 465 aa 27.3 %
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein Serotonin 3 (5-HT3) receptor   483 aa 388 aa 21.9 %
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor Serotonin 3 (5-HT3) receptor   483 aa 457 aa 26.9 %
Echinococcus multilocularis nAChR subunit Serotonin 3 (5-HT3) receptor   483 aa 495 aa 24.2 %
Onchocerca volvulus Serotonin 3 (5-HT3) receptor   483 aa 452 aa 29.2 %
Onchocerca volvulus Acetylcholine receptor subunit alpha-type des-2 homolog Serotonin 3 (5-HT3) receptor   483 aa 464 aa 24.8 %
Brugia malayi Cation transporter family protein Serotonin 3 (5-HT3) receptor   483 aa 507 aa 28.2 %
Onchocerca volvulus Acetylcholine receptor subunit alpha-type homolog Serotonin 3 (5-HT3) receptor   483 aa 465 aa 27.3 %
Loa Loa (eye worm) acetylcholine receptor alpha subunit Serotonin 3 (5-HT3) receptor   483 aa 484 aa 26.0 %
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit Serotonin 3 (5-HT3) receptor   483 aa 445 aa 25.6 %
Onchocerca volvulus Acetylcholine receptor subunit alpha-type homolog Serotonin 3 (5-HT3) receptor   483 aa 482 aa 25.1 %
Onchocerca volvulus Serotonin 3 (5-HT3) receptor   483 aa 489 aa 31.3 %
Onchocerca volvulus Serotonin 3 (5-HT3) receptor   483 aa 477 aa 26.6 %
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) Serotonin 3 (5-HT3) receptor   483 aa 503 aa 22.3 %
Onchocerca volvulus Serotonin 3 (5-HT3) receptor   483 aa 473 aa 27.5 %
Onchocerca volvulus 39S ribosomal protein L13, mitochondrial homolog Serotonin 3 (5-HT3) receptor   483 aa 490 aa 31.0 %
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit Serotonin 3 (5-HT3) receptor   483 aa 470 aa 27.7 %
Drosophila melanogaster nicotinic Acetylcholine Receptor alpha2 Serotonin 3 (5-HT3) receptor   483 aa 541 aa 25.5 %
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 Serotonin 3 (5-HT3) receptor   483 aa 387 aa 25.6 %
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative Serotonin 3 (5-HT3) receptor   483 aa 478 aa 25.1 %
Schistosoma japonicum Neuronal acetylcholine receptor subunit alpha-3 precursor, putative Serotonin 3 (5-HT3) receptor   483 aa 505 aa 21.2 %
Onchocerca volvulus Putative zinc finger protein Serotonin 3 (5-HT3) receptor   483 aa 489 aa 25.8 %
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit Serotonin 3 (5-HT3) receptor   483 aa 482 aa 23.9 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Toxoplasma gondii heat shock protein hslv, putative 0.0065 0.0619 0.1194
Brugia malayi Pre-SET motif family protein 0.0029 0.006 0.0127
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Trypanosoma cruzi proteasome beta 7 subunit, putative 0.0065 0.0619 0.0023
Plasmodium falciparum proteasome subunit beta type-2, putative 0.0159 0.2081 0.3546
Trypanosoma cruzi proteasome alpha 3 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0048 0.0347 0.0347
Schistosoma mansoni proteasome catalytic subunit 1 (T01 family) 0.0065 0.0619 0.0619
Mycobacterium leprae proteasome (beta subunit) PrcB 0.0331 0.4742 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0048 0.0347 0.0347
Toxoplasma gondii proteasome subunit beta type 2, putative 0.0159 0.2081 0.4316
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0039 0.0215 0.0215
Trypanosoma cruzi proteasome beta 2 subunit, putative 0.0065 0.0619 0.0023
Trypanosoma brucei proteasome subunit beta type-2, putative 0.0159 0.2081 0.356
Echinococcus multilocularis FTZ F1 alpha 0.0048 0.0347 0.0347
Schistosoma mansoni proteasome catalytic subunit 3 (T01 family) 0.0331 0.4742 0.4742
Brugia malayi Nuclear hormone receptor-like 1 0.0048 0.0347 0.0733
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0065 0.0619 0.0619
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0039 0.0215 0.0215
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0048 0.0347 0.0733
Echinococcus granulosus proteasome prosome macropain subunit alpha 0.0065 0.0619 0.0619
Echinococcus multilocularis proteasome subunit beta type 7 0.0065 0.0619 0.0619
Echinococcus multilocularis proteasome (prosome macropain) subunit alpha 0.0065 0.0619 0.0619
Leishmania major proteasome beta 2 subunit, putative 0.0159 0.2081 0.356
Plasmodium vivax proteasome subunit alpha type-6, putative 0.0065 0.0619 0.1194
Brugia malayi Proteasome subunit alpha type 7-1 0.0065 0.0619 0.1306
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0048 0.0347 0.0921
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0159 0.2081 0.2081
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0064 0.061 0.1174
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0044 0.0044
Trypanosoma brucei proteasome alpha 2 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni glutamate receptor NMDA 0.0029 0.0059 0.0059
Trypanosoma brucei proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Toxoplasma gondii proteasome subunit alpha1, putative 0.0065 0.0619 0.1194
Echinococcus granulosus Proteasome subunit alpha type 7 0.0065 0.0619 0.0619
Toxoplasma gondii proteasome subunit beta type 1, putative 0.0257 0.3597 0.7555
Trypanosoma brucei ATP-dependent protease subunit HslV 0.0065 0.0619 0.0023
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0048 0.0347 0.0733
Leishmania major proteasome beta 2 subunit, putative 0.0065 0.0619 0.0023
Trypanosoma cruzi proteasome subunit alpha type-5, putative 0.0065 0.0619 0.0023
Brugia malayi proteasome subunit beta type 2 0.0159 0.2081 0.4388
Schistosoma mansoni microtubule-associated protein tau 0.067 1 1
Trypanosoma cruzi proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Brugia malayi ecdysteroid receptor 0.0048 0.0347 0.0733
Schistosoma mansoni RAR-like nuclear receptor 0.0048 0.0347 0.0347
Loa Loa (eye worm) proteasome subunit beta type 2 0.0159 0.2081 0.4388
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0122 0.1506 0.1506
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.006 0.006
Plasmodium vivax proteasome subunit beta type-6, putative 0.0065 0.0619 0.1194
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0257 0.3597 0.723
Toxoplasma gondii proteasome subunit alpha type, putative 0.0065 0.0619 0.1194
Brugia malayi steroid hormone receptor 0.0048 0.0347 0.0733
Entamoeba histolytica proteasome subunit beta type 1, putative 0.0257 0.3597 0.7224
Loa Loa (eye worm) steroid hormone receptor 0.0048 0.0347 0.0733
Trypanosoma brucei proteasome subunit beta type-5, putative 0.0331 0.4742 1
Schistosoma mansoni hypothetical protein 0.0033 0.0124 0.0124
Leishmania major hs1vu complex proteolytic subunit-like,hs1vu complex proteolytic subunit-like, threonine peptidase, Clan T(1), family T1B 0.0065 0.0619 0.0023
Brugia malayi Steroid receptor seven-up type 2 0.0048 0.0347 0.0733
Schistosoma mansoni proteasome subunit alpha 3 (T01 family) 0.0065 0.0619 0.0619
Echinococcus granulosus proteasome prosome macropain subunit beta type 0.0065 0.0619 0.0619
Echinococcus granulosus proteasome subunit beta type 6 0.0065 0.0619 0.0619
Trypanosoma brucei proteasome beta 3 subunit, putative 0.0065 0.0619 0.0023
Plasmodium vivax proteasome subunit beta type-3, putative 0.0065 0.0619 0.1194
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0361 0.0762
Plasmodium vivax proteasome subunit alpha type-4, putative 0.0065 0.0619 0.1194
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0065 0.0619 0.0619
Schistosoma mansoni proteasome catalytic subunit 2 (T01 family) 0.0065 0.0619 0.0619
Mycobacterium tuberculosis Proteasome beta subunit PrcB; assembles with alpha subunit PrcA. 0.0331 0.4742 1
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0257 0.3597 0.7224
Echinococcus granulosus proteasome subunit beta type 7 0.0065 0.0619 0.0619
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0048 0.0347 0.0347
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0331 0.4742 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.006 0.006
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0048 0.0347 0.0347
Brugia malayi Proteasome subunit alpha type 1 0.0065 0.0619 0.1306
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0048 0.0347 0.0733
Echinococcus multilocularis proteasome (prosome, macropain) 0.0331 0.4742 0.4742
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0065 0.0619 0.0619
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0048 0.0347 0.0347
Trypanosoma cruzi proteasome subunit alpha type-1, putative 0.0065 0.0619 0.0023
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0189 0.2538 0.2538
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0065 0.0619 0.0619
Trypanosoma brucei proteasome alpha 3 subunit, putative 0.0065 0.0619 0.0023
Leishmania major proteasome alpha 1 subunit, putative 0.0065 0.0619 0.0023
Onchocerca volvulus 0.0048 0.0347 0.0921
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0048 0.0347 0.0347
Echinococcus multilocularis proteasome subunit beta (t family) proteasome (prosome macropain) subunit beta 0.0065 0.0619 0.0619
Schistosoma mansoni proteasome subunit alpha 7 (T01 family) 0.0065 0.0619 0.0619
Echinococcus multilocularis microtubule associated protein 2 0.067 1 1
Plasmodium vivax proteasome subunit alpha type-7, putative 0.0065 0.0619 0.1194
Brugia malayi photoreceptor-specific nuclear receptor 0.0048 0.0347 0.0733
Leishmania major proteasome alpha 5 subunit, putative,20S proteasome subunit alpha 5, (putative) 0.0065 0.0619 0.0023
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0048 0.0347 0.0347
Trypanosoma cruzi 20S proteasome subunit 0.0159 0.2081 0.356
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Brugia malayi proteasome subunit beta type 3 0.0065 0.0619 0.1306
Echinococcus granulosus proteasome subunit beta t family 0.0065 0.0619 0.0619
Brugia malayi Proteasome A-type and B-type family protein 0.0331 0.4742 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Brugia malayi Proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Brugia malayi proteasome subunit alpha type 3 0.0065 0.0619 0.1306
Echinococcus granulosus Proteasome subunit alpha beta 0.0065 0.0619 0.0619
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0048 0.0347 0.0733
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0159 0.2081 0.3546
Toxoplasma gondii proteasome subunit 0.0065 0.0619 0.1194
Toxoplasma gondii proteasome beta subunit 0.0065 0.0619 0.1194
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0048 0.0347 0.0347
Echinococcus granulosus proteasome subunit alpha type 2 0.0065 0.0619 0.0619
Loa Loa (eye worm) proteasome subunit alpha type 1 0.0065 0.0619 0.1306
Trypanosoma cruzi proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Toxoplasma gondii proteasome subunit alpha type 1, putative 0.0065 0.0619 0.1194
Loa Loa (eye worm) PDE1B protein 0.0189 0.2538 0.5352
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0048 0.0347 0.0347
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0029 0.0059 0.0059
Trypanosoma cruzi proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Echinococcus multilocularis proteasome subunit alpha type 6 0.0065 0.0619 0.0619
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0257 0.3597 0.723
Plasmodium vivax ATP-dependent protease subunit ClpQ, putative 0.0065 0.0619 0.1194
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0065 0.0619 0.0619
Leishmania major proteasome beta 3 subunit, putative 0.0065 0.0619 0.0023
Trypanosoma brucei proteasome subunit alpha type-5, putative 0.0065 0.0619 0.0023
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0048 0.0347 0.0733
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0048 0.0347 0.0733
Schistosoma mansoni steroid hormone receptor ad4bp 0.0048 0.0347 0.0347
Leishmania major proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative 0.0257 0.3597 0.723
Schistosoma mansoni glutamate receptor kainate 0.0054 0.0452 0.0452
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0065 0.0619 0.0619
Trypanosoma cruzi proteasome beta 3 subunit, putative 0.0065 0.0619 0.0023
Leishmania major proteasome beta 5 subunit, putative 0.0331 0.4742 1
Schistosoma mansoni proteasome subunit beta 1 (T01 family) 0.0257 0.3597 0.3597
Echinococcus multilocularis ecdysone induced protein 78C 0.0048 0.0347 0.0347
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0361 0.0762
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0065 0.0619 0.0619
Giardia lamblia Proteasome subunit beta type 1 0.0257 0.3597 0.7224
Leishmania major proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0048 0.0347 0.0347
Trypanosoma cruzi proteasome subunit beta type-2, putative 0.0159 0.2081 0.356
Plasmodium vivax proteasome subunit alpha type-1, putative 0.0065 0.0619 0.1194
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0064 0.061 0.1174
Wolbachia endosymbiont of Brugia malayi ATP-dependent protease peptidase subunit 0.0065 0.0619 0.5
Brugia malayi Proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Giardia lamblia Proteasome subunit beta type 5 precursor 0.0331 0.4742 1
Leishmania major proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Loa Loa (eye worm) PAS-3 protein 0.0065 0.0619 0.1306
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0048 0.0347 0.0733
Trypanosoma cruzi hslVU complex proteolytic subunit, threonine peptidase, Clan T(1), family T1B 0.0065 0.0619 0.0023
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0048 0.0347 0.0733
Brugia malayi nuclear hormone receptor 0.0048 0.0347 0.0733
Echinococcus granulosus subfamily T1A non peptidase ue 0.0065 0.0619 0.0619
Echinococcus granulosus 20S proteasome subunit alpha 6 0.0065 0.0619 0.0619
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0059 0.0524 0.0524
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0048 0.0347 0.0733
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0059 0.0524 0.0524
Trypanosoma brucei proteasome beta 6 subunit 0.0257 0.3597 0.723
Brugia malayi proteasome subunit alpha type 1 0.0065 0.0619 0.1306
Toxoplasma gondii proteasome subunit alpha2, protease of the acylase family and NTN hydrolase fold, putative 0.0065 0.0619 0.1194
Toxoplasma gondii peptidase, T1 family protein 0.0065 0.0619 0.1194
Trypanosoma brucei proteasome alpha 1 subunit, putative 0.0065 0.0619 0.0023
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0159 0.2081 0.3546
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0331 0.4742 1
Trypanosoma cruzi proteasome alpha 1 subunit, putative 0.0065 0.0619 0.0023
Plasmodium vivax proteasome subunit beta type-4, putative 0.0065 0.0619 0.1194
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.006 0.006
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0048 0.0347 0.0347
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Leishmania major proteasome alpha 3 subunit, putative 0.0065 0.0619 0.0023
Loa Loa (eye worm) proteasome subunit beta type 1 0.0257 0.3597 0.7586
Trypanosoma brucei proteasome beta 7 subunit 0.0065 0.0619 0.0023
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0048 0.0347 0.0733
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0059 0.0524 0.0524
Trypanosoma brucei Proteasome subunit A N-terminal signature/Proteasome subunit, putative 0.0065 0.0619 0.0023
Toxoplasma gondii proteasome subunit beta type, putative 0.0331 0.4742 1
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0159 0.2081 0.2081
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0048 0.0347 0.0733
Echinococcus multilocularis NMDA receptor 0.0039 0.0215 0.0215
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0257 0.3597 0.3597
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Echinococcus multilocularis 20S proteasome subunit alpha 6 0.0065 0.0619 0.0619
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0122 0.1506 0.1506
Schistosoma mansoni proteasome subunit beta 3 (T01 family) 0.0065 0.0619 0.0619
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0048 0.0347 0.0347
Trypanosoma brucei proteasome alpha 7 subunit 0.0065 0.0619 0.0023
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0039 0.0215 0.0215
Onchocerca volvulus Protein ultraspiracle homolog 0.0048 0.0347 0.0921
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0048 0.0347 0.0733
Trypanosoma cruzi proteasome subunit alpha type-5, putative 0.0065 0.0619 0.0023
Echinococcus granulosus FTZ F1 alpha 0.0048 0.0347 0.0347
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Loa Loa (eye worm) hypothetical protein 0.0029 0.006 0.0127
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Leishmania major proteasome alpha 2 subunit, putative 0.0065 0.0619 0.0023
Loa Loa (eye worm) proteasome subunit alpha type 3 0.0065 0.0619 0.1306
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0124 0.0261
Schistosoma mansoni nuclear hormone receptor 0.0048 0.0347 0.0347
Echinococcus multilocularis proteasome (prosome macropain) subunit beta type 0.0065 0.0619 0.0619
Plasmodium vivax proteasome subunit beta type-1, putative 0.0257 0.3597 0.7555
Loa Loa (eye worm) proteasome subunit alpha type 6 0.0065 0.0619 0.1306
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.006 0.006
Trypanosoma cruzi proteasome alpha 2 subunit, putative 0.0065 0.0619 0.0023
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0331 0.4742 1
Mycobacterium ulcerans proteasome PrcB 0.0331 0.4742 1
Onchocerca volvulus Notchless protein homolog 0.0065 0.0619 0.1793
Entamoeba histolytica proteasome subunit beta type 5 precursor, putative 0.0331 0.4742 1
Loa Loa (eye worm) proteasome subunit beta type 3 0.0065 0.0619 0.1306
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.006 0.006
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0059 0.0524 0.0524
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0048 0.0347 0.0347
Loa Loa (eye worm) 20S proteasome alpha5 subunit 0.0065 0.0619 0.1306
Loa Loa (eye worm) hypothetical protein 0.0033 0.0124 0.0261
Schistosoma mansoni hypothetical protein 0.0122 0.1506 0.1506
Trichomonas vaginalis set domain proteins, putative 0.023 0.3177 0.6204
Entamoeba histolytica probable proteasome subunit beta type 2, putative 0.0159 0.2081 0.3546
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0048 0.0347 0.0347
Brugia malayi 20S proteasome alpha5 subunit 0.0065 0.0619 0.1306
Schistosoma mansoni proteasome subunit beta 3 (T01 family) 0.0065 0.0619 0.0619
Echinococcus multilocularis thyroid hormone receptor alpha 0.017 0.2243 0.2243
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0048 0.0347 0.0733
Brugia malayi proteasome subunit alpha type 4 0.0065 0.0619 0.1306
Leishmania major proteasome beta 7 subunit, putative 0.0065 0.0619 0.0023
Brugia malayi nuclear receptor NHR-88 0.0048 0.0347 0.0733
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0048 0.0347 0.0347
Plasmodium falciparum proteasome subunit beta type-5 0.0331 0.4742 1
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0029 0.0059 0.0059
Schistosoma mansoni glutamate receptor kainate 0.0054 0.0452 0.0452
Loa Loa (eye worm) hypothetical protein 0.0048 0.0347 0.0733
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0059 0.0524 0.0524
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0159 0.2081 0.2081
Trypanosoma brucei proteasome beta 2 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0159 0.2081 0.2081
Brugia malayi proteasome subunit alpha type 6 0.0065 0.0619 0.1306
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0048 0.0347 0.0347
Brugia malayi Proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Trypanosoma cruzi proteasome alpha 1 subunit, putative 0.0065 0.0619 0.0023
Giardia lamblia Proteasome subunit beta type 2 0.0159 0.2081 0.3546
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0048 0.0347 0.0733
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.006 0.006
Trypanosoma cruzi ATP-dependent protease subunit HslV, putative 0.0065 0.0619 0.0023
Echinococcus granulosus glutamate receptor 2 0.0029 0.0059 0.0059
Onchocerca volvulus Bile acid receptor homolog 0.0048 0.0347 0.0921
Schistosoma mansoni thyroid hormone receptor 0.017 0.2243 0.2243
Leishmania major 20s proteasome beta 7 subunit, (putative) 0.0065 0.0619 0.0023
Schistosoma mansoni proteasome subunit alpha 1 (T01 family) 0.0065 0.0619 0.0619
Toxoplasma gondii proteasome subunit beta type 7 precursor, putative 0.0065 0.0619 0.1194
Echinococcus multilocularis proteasome subunit beta type 6 0.0065 0.0619 0.0619
Trypanosoma cruzi proteasome beta-1 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni retinoic acid receptor RXR 0.0048 0.0347 0.0347
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0059 0.0524 0.0524
Brugia malayi Pre-SET motif family protein 0.0202 0.2744 0.5787
Trypanosoma brucei proteasome beta-1 subunit, putative 0.0065 0.0619 0.0023
Loa Loa (eye worm) proteasome subunit alpha type 7-1 0.0065 0.0619 0.1306
Echinococcus multilocularis subfamily T1A non peptidase ue 0.0065 0.0619 0.0619
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0257 0.3597 0.3597
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0189 0.2538 0.2538
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0189 0.2538 0.2538
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0048 0.0347 0.0733
Leishmania major proteasome alpha 1 subunit, putative 0.0065 0.0619 0.0023
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0039 0.0215 0.0215
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0048 0.0347 0.0347
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0048 0.0347 0.0347
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0064 0.061 0.1174
Echinococcus multilocularis glutamate receptor 2 0.0029 0.0059 0.0059
Trypanosoma cruzi proteasome beta-1 subunit, putative 0.0065 0.0619 0.0023
Plasmodium vivax proteasome subunit beta type-5, putative 0.0331 0.4742 1
Echinococcus multilocularis Proteasome, subunit alpha beta 0.0065 0.0619 0.0619
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0048 0.0347 0.0733
Plasmodium falciparum proteasome subunit beta type-1, putative 0.0257 0.3597 0.7224
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0048 0.0347 0.0733
Schistosoma mansoni proteasome subunit alpha 4 (T01 family) 0.0065 0.0619 0.0619
Echinococcus multilocularis proteasome subunit alpha type 2 0.0065 0.0619 0.0619
Plasmodium vivax proteasome subunit beta type-7, putative 0.0065 0.0619 0.1194
Plasmodium vivax proteasome subunit alpha type-3, putative 0.0065 0.0619 0.1194
Echinococcus granulosus proteasome prosome macropain 0.0331 0.4742 0.4742
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.006 0.006
Trypanosoma cruzi proteasome alpha 2 subunit, putative 0.0065 0.0619 0.0023
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0064 0.061 0.061
Trypanosoma cruzi proteasome alpha 3 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni thyroid hormone receptor 0.017 0.2243 0.2243
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0361 0.0762
Echinococcus granulosus ecdysone induced protein 78C 0.0048 0.0347 0.0347
Loa Loa (eye worm) hypothetical protein 0.0048 0.0361 0.0762
Echinococcus granulosus proteasome subunit alpha type 6 0.0065 0.0619 0.0619
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0065 0.0619 0.1306
Plasmodium vivax proteasome subunit alpha type-5, putative 0.0065 0.0619 0.1194
Toxoplasma gondii 20S proteasome subunit beta 7, putative 0.0065 0.0619 0.1194
Leishmania major proteasome beta-1 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni proteasome subunit beta 4 (T01 family) 0.0065 0.0619 0.0619
Brugia malayi proteasome subunit alpha type 2 0.0065 0.0619 0.1306
Schistosoma mansoni coup transcription factor 0.0048 0.0347 0.0347
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0189 0.2538 0.5352
Loa Loa (eye worm) proteasome subunit alpha type 2 0.0065 0.0619 0.1306
Schistosoma mansoni proteasome subunit alpha 2 (T01 family) 0.0065 0.0619 0.0619
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0048 0.0347 0.0733
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0048 0.0347 0.0733
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0048 0.0347 0.0733
Trypanosoma cruzi proteasome beta 3 subunit, putative 0.0065 0.0619 0.0023
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0064 0.061 0.061
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0048 0.0347 0.0347
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0331 0.4742 1
Onchocerca volvulus 0.023 0.3177 1
Toxoplasma gondii proteasome subunit alpha type 5-2, putative 0.0065 0.0619 0.1194
Plasmodium vivax proteasome subunit beta type-2, putative 0.0159 0.2081 0.4316
Trypanosoma cruzi proteasome alpha 7 subunit, putative 0.0065 0.0619 0.0023
Schistosoma mansoni proteasome subunit alpha 6 (T01 family) 0.0065 0.0619 0.0619
Plasmodium vivax proteasome subunit alpha type-2, putative 0.0065 0.0619 0.1194
Brugia malayi proteasome subunit beta type 1 0.0257 0.3597 0.7586
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.2744 0.5787

Activities

Activity type Activity value Assay description Source Reference
ID50 (functional) = 1.6 ug kg-1 Antagonism of the bradycardia induced by iv injection of 5-HT(10-30 microg/kg) was evaluated by the compound administration in rat; 0.7-3.6 ChEMBL. No reference
Ki (binding) = 0.15 nM Binding affinity at 5-hydroxytryptamine 3 receptor in rat posterior cortex by [3H]-BRL 43694 displacement. ChEMBL. No reference
Ki (binding) = 0.15 nM Binding affinity of the compound to 5-hydroxytryptamine 3 receptor in rat entorhinal cortex using [3H]-BRL 43694 as radioligand ChEMBL. No reference
Ki (binding) = 0.15 nM Binding affinity at 5-hydroxytryptamine 3 receptor in rat posterior cortex by [3H]-BRL 43694 displacement. ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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