Detailed information for compound 253057

Basic information

Technical information
  • TDR Targets ID: 253057
  • Name: 2-(5,6-dihydrobenzo[b][1]benzoxepin-6-ylsulfa nyl)-N,N-diethylethanamine
  • MW: 327.484 | Formula: C20H25NOS
  • H donors: 0 H acceptors: 0 LogP: 4.74 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCSC1Cc2ccccc2Oc2c1cccc2)CC
  • InChi: 1S/C20H25NOS/c1-3-21(4-2)13-14-23-20-15-16-9-5-7-11-18(16)22-19-12-8-6-10-17(19)20/h5-12,20H,3-4,13-15H2,1-2H3
  • InChiKey: ZLNOSYSAPKRDEO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(5,6-dihydrobenzo[b][1]benzoxepin-6-ylsulfanyl)-N,N-diethyl-ethanamine
  • 2-(5,6-dihydrobenzo[b][1]benzoxepin-6-ylthio)-N,N-diethylethanamine
  • 2-(5,6-dihydrobenzo[b][1]benzoxepin-6-ylthio)ethyl-diethyl-amine

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0029 0.0799 0.2694
Brugia malayi Tachykinin-like peptides receptor 99D 0.0029 0.0799 0.091
Brugia malayi Serotonin receptor 0.0029 0.0799 0.091
Trypanosoma cruzi aldehyde dehydrogenase, putative 0.0002 0 0.5
Brugia malayi Serotonin receptor 0.0029 0.0799 0.091
Onchocerca volvulus Neuropeptide F receptor homolog 0.0029 0.0799 0.0799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Onchocerca volvulus 0.0029 0.0799 0.0799
Brugia malayi follicle stimulating hormone receptor 0.0029 0.0799 0.091
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0029 0.0799 0.6653
Onchocerca volvulus 0.0029 0.0799 0.0799
Onchocerca volvulus 0.0043 0.1201 0.1201
Trypanosoma cruzi aldehyde dehydrogenase, putative 0.0002 0 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0042 0.1165 1
Echinococcus granulosus muscleblind protein 0.0103 0.2966 1
Brugia malayi putative neuropeptide receptor 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus biogenic amine 5HT receptor 0.0029 0.0799 0.2694
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0799 0.2694
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0042 0.1165 0.3929
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0035 0.0947 0.7888
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0029 0.0799 0.091
Brugia malayi RE15519p 0.0029 0.0799 0.091
Trichomonas vaginalis set domain proteins, putative 0.0342 1 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Onchocerca volvulus 0.0029 0.0799 0.0799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0799 0.6653
Onchocerca volvulus 0.0029 0.0799 0.0799
Brugia malayi Dopamine receptor 0.0029 0.0799 0.091
Echinococcus multilocularis serotonin receptor 0.0029 0.0799 0.2694
Onchocerca volvulus 0.0029 0.0799 0.0799
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0029 0.0799 0.091
Echinococcus granulosus peptide allatostatin:somatostatin 0.0029 0.0799 0.2694
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0029 0.0799 0.6653
Schistosoma mansoni histamine h1 receptor 0.0029 0.0799 0.6653
Echinococcus granulosus somatostatin receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0799 0.2694
Echinococcus granulosus orexin receptor type 2 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0029 0.0799 0.2694
Trichomonas vaginalis ral, putative 0.0097 0.2777 0.2777
Onchocerca volvulus 0.0029 0.0799 0.0799
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0029 0.0799 0.2694
Schistosoma mansoni neuropeptide receptor 0.0029 0.0799 0.6653
Echinococcus multilocularis somatostatin receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0103 0.2966 0.3379
Trichomonas vaginalis rap1 and, putative 0.0097 0.2777 0.2777
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis neuropeptide receptor A26 0.0029 0.0799 0.2694
Trichomonas vaginalis rheb, putative 0.0097 0.2777 0.2777
Mycobacterium ulcerans aldehyde dehydrogenase 0.0042 0.1165 1
Onchocerca volvulus 0.0029 0.0799 0.0799
Trypanosoma cruzi pyrroline-5-carboxylate synthetase-like protein, putative 0.0002 0 0.5
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0029 0.0799 0.6653
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0799 0.2694
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Schistosoma mansoni aldehyde dehydrogenase 0.0042 0.1165 0.9703
Brugia malayi Dopamine receptor protein 1 0.0029 0.0799 0.091
Brugia malayi putative neuropeptide receptor NPR1 0.0029 0.0799 0.091
Schistosoma mansoni hypothetical protein 0.0029 0.0799 0.6653
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0799 0.6653
Trypanosoma cruzi aldehyde dehydrogenase, putative 0.0002 0 0.5
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis G protein coupled receptor 139 0.0029 0.0799 0.2694
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0799 0.2694
Brugia malayi GnHR receptor homolog 0.0029 0.0799 0.091
Trypanosoma cruzi pyrroline-5-carboxylate synthetase-like protein, putative 0.0002 0 0.5
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni alpha-1 adrenergic receptor 0.0029 0.0799 0.6653
Echinococcus granulosus sex peptide receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0799 0.2694
Entamoeba histolytica Ras family GTPase 0.0097 0.2777 1
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni growth hormone secretagogue receptor 0.0029 0.0799 0.6653
Echinococcus granulosus alpha 1A adrenergic receptor 0.0029 0.0799 0.2694
Schistosoma mansoni neuropeptide f receptor 76f 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0029 0.0799 0.2694
Mycobacterium ulcerans aldehyde dehydrogenase 0.0042 0.1165 1
Brugia malayi larval opioid receptor 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0042 0.1165 1
Brugia malayi Ras protein let-60 0.0097 0.2777 0.3164
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0799 0.2694
Onchocerca volvulus 0.0029 0.0799 0.0799
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0799 0.2694
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0035 0.0947 0.3194
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Entamoeba histolytica ras-1, putative 0.0097 0.2777 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Trypanosoma brucei delta-1-pyrroline-5-carboxylate dehydrogenase, putative 0.0002 0 0.5
Schistosoma mansoni opsin-like receptor 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Onchocerca volvulus 0.0029 0.0799 0.0799
Echinococcus multilocularis serotonin receptor 0.0029 0.0799 0.2694
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0035 0.0947 0.7888
Brugia malayi Pre-SET motif family protein 0.0301 0.8778 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0029 0.0799 0.091
Schistosoma mansoni neuropeptide receptor 0.0029 0.0799 0.6653
Schistosoma mansoni opsin-like receptor 0.0029 0.0799 0.6653
Loa Loa (eye worm) TYRA-2 protein 0.0029 0.0799 0.091
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0799 0.2694
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0799 0.6653
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0799 0.2694
Schistosoma mansoni biogenic amine (5HT) receptor 0.0029 0.0799 0.6653
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus G protein coupled receptor 139 0.0029 0.0799 0.2694
Brugia malayi Ras-related protein R-Ras2 0.0097 0.2777 0.3164
Brugia malayi G protein-coupled receptor F59B2.13 0.0029 0.0799 0.091
Schistosoma mansoni amine GPCR 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Brugia malayi G-protein coupled receptor 0.0029 0.0799 0.091
Echinococcus multilocularis muscleblind protein 0.0103 0.2966 1
Trypanosoma cruzi aldehyde dehydrogenase, putative 0.0002 0 0.5
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0043 0.1201 1
Loa Loa (eye worm) Ras protein let-60 0.0097 0.2777 0.3164
Giardia lamblia Alcohol dehydrogenase 0.0002 0 0.5
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0042 0.1154 0.3892
Treponema pallidum gamma-glutamyl phosphate reductase 0.0002 0 0.5
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Onchocerca volvulus 0.0029 0.0799 0.0799
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis orexin receptor type 2 0.0029 0.0799 0.2694
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Wolbachia endosymbiont of Brugia malayi bifunctional proline dehydrogenase/pyrroline-5-carboxylate dehydrogenase 0.0002 0 0.5
Schistosoma mansoni hypothetical protein 0.0029 0.0799 0.6653
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0799 0.091
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni adenoreceptor 0.0029 0.0799 0.6653
Brugia malayi neuropeptide F receptor 0.0029 0.0799 0.091
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0029 0.0799 0.6653
Trypanosoma cruzi delta-1-pyrroline-5-carboxylate dehydrogenase, putative 0.0002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0799 0.2694
Echinococcus granulosus allatostatin A receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0799 0.091
Echinococcus granulosus neuropeptide receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0043 0.1201 0.1368
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0301 0.8778 1
Schistosoma mansoni biogenic amine receptor 0.0029 0.0799 0.6653
Brugia malayi ORL1-like opioid receptor 0.0029 0.0799 0.091
Echinococcus granulosus g protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0035 0.0947 0.1079
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Echinococcus granulosus histone lysine methyltransferase setb 0.0043 0.1201 0.4049
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis neuropeptide FF receptor 2 0.0029 0.0799 0.2694
Schistosoma mansoni biogenic amine (5HT) receptor 0.0029 0.0799 0.6653
Entamoeba histolytica Ras family GTPase 0.0097 0.2777 1
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0799 0.2694
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0799 0.6653
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0799 0.6653
Onchocerca volvulus 0.0029 0.0799 0.0799
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0799 0.2694
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0043 0.1201 1
Echinococcus granulosus dro:myosuppressin receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0029 0.0799 0.091
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Trichomonas vaginalis GTP-binding protein rit, putative 0.0097 0.2777 0.2777
Loa Loa (eye worm) melatonin receptor type 1A 0.0029 0.0799 0.091
Schistosoma mansoni aldehyde dehydrogenase 0.0042 0.1165 0.9703
Echinococcus granulosus g-protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0799 0.2694
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0029 0.0799 0.091
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0029 0.0799 0.6653
Echinococcus granulosus serotonin receptor 0.0029 0.0799 0.2694
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0799 0.6653
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni amine GPCR 0.0029 0.0799 0.6653
Brugia malayi Muscleblind-like protein 0.0103 0.2966 0.3379
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0103 0.2966 0.3379
Onchocerca volvulus 0.0029 0.0799 0.0799
Loa Loa (eye worm) hypothetical protein 0.0097 0.2777 0.3164
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0029 0.0799 0.0799
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Mycobacterium leprae PROBABLE ALDEHYDE DEHYDROGENASE (NAD+) DEPENDENT 0.0002 0 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Echinococcus granulosus neuropeptide FF receptor 2 0.0029 0.0799 0.2694
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0799 0.091
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0043 0.1201 0.4049
Trypanosoma cruzi aldehyde dehydrogenase family, putative 0.0002 0 0.5
Echinococcus granulosus tachykinin peptides receptor 99D 0.0029 0.0799 0.2694
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0042 0.1165 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0029 0.0799 0.2694
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0043 0.1201 1
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0799 0.2694
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0035 0.0947 0.3194
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0035 0.0947 0.1079
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni myosin xvIII 0.0029 0.0799 0.6653
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0799 0.2694
Schistosoma mansoni hypothetical protein 0.0029 0.0799 0.6653
Brugia malayi Melatonin receptor type 1A 0.0029 0.0799 0.091
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Mycobacterium leprae PROBABLE GAMMA-GLUTAMYL PHOSPHATE REDUCTASE PROTEIN PROA (GPR) (GLUTAMATE-5-SEMIALDEHYDE DEHYDROGENASE) (GLUTAMYL-GAMMA-SEMIALDE 0.0002 0 0.5
Echinococcus granulosus neuropeptide receptor A26 0.0029 0.0799 0.2694
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0799 0.2694
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0029 0.0799 0.091
Echinococcus granulosus g protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus granulosus biogenic amine 5HT receptor 0.0029 0.0799 0.2694
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Trichomonas vaginalis dexras1, putative 0.0097 0.2777 0.2777
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Onchocerca volvulus 0.0029 0.0799 0.0799
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0043 0.1201 0.4049
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0029 0.0799 0.6653
Brugia malayi Pre-SET motif family protein 0.0043 0.1201 0.1368
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Brugia malayi AKH receptor 0.0029 0.0799 0.091
Brugia malayi sulfakinin receptor protein 0.0029 0.0799 0.091
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Schistosoma mansoni neuropeptide receptor 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni opsin-like receptor 0.0029 0.0799 0.6653
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0799 0.2694
Schistosoma mansoni biogenic amine receptor 0.0029 0.0799 0.6653
Brugia malayi neuropeptide F receptor 0.0029 0.0799 0.091
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Trypanosoma brucei aldehyde dehydrogenase, putative 0.0002 0 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0799 0.6653
Brugia malayi hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis sex peptide receptor 0.0029 0.0799 0.2694
Echinococcus granulosus fmrfamide receptor 0.0029 0.0799 0.2694
Trypanosoma cruzi aldehyde dehydrogenase, putative 0.0002 0 0.5
Onchocerca volvulus 0.0029 0.0799 0.0799
Schistosoma mansoni hypothetical protein 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Onchocerca volvulus 0.0029 0.0799 0.0799
Trichomonas vaginalis ras-dva small GTPase, putative 0.0097 0.2777 0.2777
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0042 0.1165 0.3929
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus neuropeptide s receptor 0.0029 0.0799 0.2694
Brugia malayi G-protein coupled receptor 0.0029 0.0799 0.091
Echinococcus multilocularis g-protein coupled receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus g protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis ras gtpase 0.0097 0.2777 0.9363
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0035 0.0947 0.3194
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0043 0.1201 1
Echinococcus granulosus hypothetical protein 0.0029 0.0799 0.2694
Onchocerca volvulus 0.0029 0.0799 0.0799
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0029 0.0799 0.091
Echinococcus multilocularis allatostatin A receptor 0.0029 0.0799 0.2694
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis dro:myosuppressin receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0799 0.2694
Trypanosoma brucei aldehyde dehydrogenase, putative 0.0002 0 0.5
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0799 0.2694
Echinococcus granulosus 7TM GPCR rhodopsin 0.0029 0.0799 0.2694
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0035 0.0947 0.7888
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0029 0.0799 0.6653
Trypanosoma brucei aldehyde dehydrogenase family, putative 0.0002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus granulosus neuropeptide receptor 0.0029 0.0799 0.2694
Toxoplasma gondii aldehyde dehydrogenase 0.0042 0.1165 0.9703
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0799 0.6653
Brugia malayi G protein-coupled receptor 0.0029 0.0799 0.091
Schistosoma mansoni neuropeptide receptor 0.0029 0.0799 0.6653
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0035 0.0947 0.3194
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Trypanosoma cruzi aldehyde dehydrogenase family, putative 0.0002 0 0.5
Schistosoma mansoni amine GPCR 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0799 0.2694
Plasmodium vivax SET domain protein, putative 0.0043 0.1201 0.5
Trypanosoma cruzi delta-1-pyrroline-5-carboxylate dehydrogenase, putative 0.0002 0 0.5
Schistosoma mansoni amine GPCR 0.0029 0.0799 0.6653
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Onchocerca volvulus 0.0029 0.0799 0.0799
Trypanosoma cruzi aldehyde dehydrogenase family, putative 0.0002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.0799 0.091
Schistosoma mansoni amine GPCR 0.0029 0.0799 0.6653
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0029 0.0799 0.091
Trypanosoma brucei aldehyde dehydrogenase family, putative 0.0002 0 0.5
Echinococcus multilocularis muscleblind protein 1 0.0103 0.2966 1
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0799 0.2694
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0799 0.2694
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0029 0.0799 0.2694
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0029 0.0799 0.2694
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0043 0.1201 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0029 0.0799 0.091
Echinococcus multilocularis neuropeptide s receptor 0.0029 0.0799 0.2694
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0029 0.0799 0.2694
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0799 0.2694
Echinococcus granulosus 7tm_1 domain containing protein 0.0029 0.0799 0.2694
Echinococcus granulosus ras gtpase 0.0097 0.2777 0.9363
Mycobacterium leprae PROBABLE SUCCINATE-SEMIALDEHYDE DEHYDROGENASE [NADP+] DEPENDENT (SSDH) GABD 0.0002 0 0.5
Schistosoma mansoni biogenic amine receptor 0.0029 0.0799 0.6653
Brugia malayi Dopamine receptor protein 2 0.0029 0.0799 0.091

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 6.9 mg kg-1 Analgesic activity for the inhibition of phenylquinone induced writhing (PQW) after subcutaneous administration to mice ChEMBL. 6103962
ED50 (functional) = 6.9 mg kg-1 Analgesic activity for the inhibition of phenylquinone induced writhing (PQW) after subcutaneous administration to mice ChEMBL. 6103962
ED50 (functional) > 20 mg kg-1 Antidepressant activity to prevent tetrabenazine induced ptosis (TBZ) in mice after intraperitoneal administration ChEMBL. 6103962
ED50 (functional) > 20 mg kg-1 Antipsychotic activity to prevent amphetamine induced lethality in mice after oral administration ChEMBL. 6103962
ED50 (functional) > 20 mg kg-1 Antidepressant activity to prevent tetrabenazine induced ptosis (TBZ) in mice after intraperitoneal administration ChEMBL. 6103962
ED50 (functional) > 20 mg kg-1 Antipsychotic activity to prevent amphetamine induced lethality in mice after oral administration ChEMBL. 6103962
ED50 (functional) > 25 mg kg-1 Delay in response to noxious heat stimuli in mice by tail flick method after subcutaneous administration ChEMBL. 6103962
ED50 (functional) > 25 mg kg-1 Delay in response to noxious heat stimuli in mice by tail flick method after subcutaneous administration ChEMBL. 6103962
ED50 (functional) > 50 mg kg-1 Anticonvulsant activity to prevent pentamethylenetetrazol (MTZ) induced lethality in mice after oral administration ChEMBL. 6103962
ED50 (functional) > 50 mg kg-1 Anticonvulsant activity to prevent pentamethylenetetrazol (MTZ) induced lethality in mice after oral administration ChEMBL. 6103962

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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