Detailed information for compound 1824717

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 352.425 | Formula: C18H28N2O5
  • H donors: 3 H acceptors: 5 LogP: -0.88 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1C[C@@H]2CNC[C@H](C1)C2)CC1CCCC1.OC(=O)/C=C/C(=O)O
  • InChi: 1S/C14H24N2O.C4H4O4/c17-14(6-11-3-1-2-4-11)16-9-12-5-13(10-16)8-15-7-12;5-3(6)1-2-4(7)8/h11-13,15H,1-10H2;1-2H,(H,5,6)(H,7,8)/b;2-1+/t12-,13+;
  • InChiKey: JVAJFYLNHJNFTM-KJSAPPNASA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Neuronal acetylcholine receptor; alpha4/beta2 Starlite/ChEMBL 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
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis neuropeptides capa receptor 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0367 1 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.0216 0.5622 1
Loa Loa (eye worm) G-protein coupled receptor 0.0216 0.5622 1
Echinococcus granulosus g-protein coupled receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0216 0.5622 1
Brugia malayi ORL1-like opioid receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus allatostatin A receptor 0.0216 0.5622 1
Leishmania major oxidoreductase-like protein 0.0025 0.0066 0.5
Schistosoma mansoni histamine h1 receptor 0.0216 0.5622 1
Brugia malayi Serotonin receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Brugia malayi neuropeptide F receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) neuropeptide F receptor 0.0216 0.5622 1
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0066 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0066 0.5
Echinococcus granulosus biogenic amine 5HT receptor 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus neuropeptide FF receptor 2 0.0216 0.5622 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Entamoeba histolytica 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0025 0.0066 0.5
Brugia malayi follicle stimulating hormone receptor 0.0216 0.5622 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0216 0.5622 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni amine GPCR 0.0216 0.5622 1
Brugia malayi Serotonin receptor 0.0216 0.5622 1
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0367 1 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) retinol dehydrogenase 12 0.0025 0.0066 0.0118
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0216 0.5622 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0216 0.5622 1
Echinococcus granulosus 7tm_1 domain containing protein 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0216 0.5622 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0216 0.5622 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0216 0.5622 1
Echinococcus multilocularis fmrfamide receptor 0.0216 0.5622 1
Brugia malayi Melatonin receptor type 1A 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0066 0.0118
Echinococcus multilocularis neuropeptide receptor A26 0.0216 0.5622 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0216 0.5622 1
Echinococcus granulosus g protein coupled receptor 0.0216 0.5622 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0216 0.5622 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0216 0.5622 1
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0066 0.5
Schistosoma mansoni myosin xvIII 0.0216 0.5622 1
Schistosoma mansoni amine GPCR 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0216 0.5622 1
Echinococcus multilocularis g protein coupled receptor 0.0216 0.5622 1
Trypanosoma brucei pteridine reductase 1 0.0025 0.0066 0.5
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus neuropeptide s receptor 0.0216 0.5622 1
Brugia malayi sulfakinin receptor protein 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0367 1 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus tm gpcr rhodopsin 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0216 0.5622 1
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0025 0.0066 0.0118
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0216 0.5622 1
Echinococcus granulosus 3 oxoacyl acyl carrier protein reductase 0.0025 0.0066 0.0118
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus tm gpcr rhodopsin 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis g-protein coupled receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Schistosoma mansoni hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis g protein coupled receptor 0.0216 0.5622 1
Schistosoma mansoni growth hormone secretagogue receptor 0.0216 0.5622 1
Echinococcus multilocularis fmrfamide receptor 0.0216 0.5622 1
Brugia malayi Dopamine receptor 0.0216 0.5622 1
Echinococcus granulosus orexin receptor type 2 0.0216 0.5622 1
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0025 0.0066 0.5
Brugia malayi hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus dro:myosuppressin receptor 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0216 0.5622 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0216 0.5622 1
Echinococcus granulosus neuropeptide Y receptor 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) oxidoreductase 0.0025 0.0066 0.0118
Schistosoma mansoni biogenic amine receptor 0.0216 0.5622 1
Schistosoma mansoni neuropeptide F-like receptor 0.0216 0.5622 1
Echinococcus granulosus neuropeptide Y receptor 0.0216 0.5622 1
Schistosoma mansoni neuropeptide receptor 0.0216 0.5622 1
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0367 1 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0216 0.5622 1
Leishmania major pteridine reductase 1 0.0025 0.0066 0.5
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0066 0.5
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus granulosus fmrfamide receptor 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Schistosoma mansoni neuropeptide receptor 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus neuropeptide receptor 0.0216 0.5622 1
Echinococcus multilocularis serotonin receptor 0.0216 0.5622 1
Echinococcus granulosus G protein coupled receptor 139 0.0216 0.5622 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0216 0.5622 1
Echinococcus granulosus hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus g protein coupled receptor 0.0216 0.5622 1
Leishmania major 3-oxoacyl-ACP reductase, putative 0.0025 0.0066 0.5
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni biogenic amine receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus neuropeptides capa receptor 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Echinococcus granulosus g protein coupled receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Brugia malayi putative neuropeptide receptor NPR1 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0216 0.5622 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0216 0.5622 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0216 0.5622 1
Trichomonas vaginalis hypothetical protein 0.0367 1 0.5
Echinococcus granulosus neuropeptide receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Schistosoma mansoni amine GPCR 0.0216 0.5622 1
Echinococcus granulosus neuropeptide receptor A26 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0066 0.0118
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) neuropeptide F receptor 0.0216 0.5622 1
Schistosoma mansoni amine GPCR 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni 3-oxoacyl-[ACP] reductase 0.0025 0.0066 0.0118
Schistosoma mansoni neuropeptide F-like receptor 0.0216 0.5622 1
Echinococcus multilocularis neuropeptide receptor 0.0216 0.5622 1
Schistosoma mansoni neuropeptide receptor 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni opsin-like receptor 0.0216 0.5622 1
Brugia malayi Dopamine receptor protein 2 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis sex peptide receptor 0.0216 0.5622 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0216 0.5622 1
Loa Loa (eye worm) TYRA-2 protein 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis neuropeptides capa receptor 0.0216 0.5622 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0216 0.5622 1
Brugia malayi larval opioid receptor 0.0216 0.5622 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0216 0.5622 1
Brugia malayi G protein-coupled receptor 0.0216 0.5622 1
Echinococcus multilocularis g protein coupled receptor 0.0216 0.5622 1
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0367 1 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0216 0.5622 1
Echinococcus granulosus serotonin receptor 0.0216 0.5622 1
Brugia malayi G-protein coupled receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Brugia malayi GnHR receptor homolog 0.0216 0.5622 1
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0216 0.5622 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0216 0.5622 1
Echinococcus granulosus somatostatin receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0216 0.5622 1
Schistosoma mansoni adenoreceptor 0.0216 0.5622 1
Schistosoma mansoni opsin-like receptor 0.0216 0.5622 1
Schistosoma mansoni hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis 3 oxoacyl acyl carrier protein reductase 0.0025 0.0066 0.0118
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis somatostatin receptor 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0216 0.5622 1
Loa Loa (eye worm) G-protein coupled receptor 0.0216 0.5622 1
Echinococcus multilocularis orexin receptor type 2 0.0216 0.5622 1
Echinococcus multilocularis neuropeptide Y receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Onchocerca volvulus 0.0025 0.0066 0.0118
Echinococcus multilocularis neuropeptide receptor 0.0216 0.5622 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0066 0.0118
Trypanosoma brucei beta-ketoacyl-ACP reductase 0.0025 0.0066 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus sex peptide receptor 0.0216 0.5622 1
Echinococcus multilocularis serotonin receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis neuropeptide Y receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0367 1 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0216 0.5622 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0216 0.5622 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.0216 0.5622 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1
Brugia malayi RE15519p 0.0216 0.5622 1
Onchocerca volvulus 0.0025 0.0066 0.0118
Brugia malayi putative neuropeptide receptor 0.0216 0.5622 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0216 0.5622 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0216 0.5622 1
Brugia malayi AKH receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0216 0.5622 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0216 0.5622 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0216 0.5622 1
Schistosoma mansoni opsin-like receptor 0.0216 0.5622 1
Brugia malayi neuropeptide F receptor 0.0216 0.5622 1
Trypanosoma brucei oxidoreductase-like protein 0.0025 0.0066 0.5
Echinococcus granulosus tm gpcr rhodopsin 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis G protein coupled receptor 139 0.0216 0.5622 1
Schistosoma mansoni hypothetical protein 0.0216 0.5622 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0216 0.5622 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0216 0.5622 1
Schistosoma mansoni dihydropteridine reductase 0.0025 0.0066 0.0118
Echinococcus granulosus rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus granulosus neuropeptides capa receptor 0.0216 0.5622 1
Brugia malayi Dopamine receptor protein 1 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0216 0.5622 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0216 0.5622 1
Echinococcus multilocularis allatostatin A receptor 0.0216 0.5622 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0216 0.5622 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.5622 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0216 0.5622 1
Brugia malayi hypothetical protein 0.0216 0.5622 1
Plasmodium falciparum enoyl-acyl carrier reductase 0.0367 1 1
Schistosoma mansoni biogenic amine receptor 0.0216 0.5622 1
Schistosoma mansoni neuropeptide receptor 0.0216 0.5622 1
Schistosoma mansoni amine GPCR 0.0216 0.5622 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0216 0.5622 1
Echinococcus multilocularis neuropeptide s receptor 0.0216 0.5622 1
Brugia malayi G-protein coupled receptor 0.0216 0.5622 1
Onchocerca volvulus 0.0216 0.5622 1

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) Agonist activity at human alpha3beta4 nAChR expressed in Xenopus laevis oocytes at 10 uM incubated for 8 secs followed by compound washout for 241 secs by Two-electrode voltage clamp assay ChEMBL. 24156938
Activity (binding) Antagonist activity at mouse alpha1beta1epsilondelta nAChR expressed in Xenopus laevis oocytes assessed as inhibition of acetylcholine-induced effect at 10 uM incubated for 8 secs followed by compound washout for 241 secs by Two-electrode voltage clamp assay ChEMBL. 24156938
Activity (binding) Antagonist activity at human alpha7 nAChR expressed in Xenopus laevis oocytes assessed as inhibition of acetylcholine-induced effect at 10 uM incubated for 12 secs followed by compound washout for 181 secs by Two-electrode voltage clamp assay ChEMBL. 24156938
Ki (binding) Displacement of [3H]methyllycaconitine from alpha7 nAChR in Sprague-Dawley rat forebrain P2 fraction after 90 mins by liquid scintillation counting analysis ChEMBL. 24156938
Ki (binding) = 43.5 nM Displacement of [3H]epibatidine from alpha4beta2 nAChR in Sprague-Dawley rat forebrain P2 fraction after 90 mins by liquid scintillation counting analysis ChEMBL. 24156938

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.