Detailed information for compound 989607

Basic information

Technical information
  • TDR Targets ID: 989607
  • Name: 3-oxo-N-(5-phenylpyrazin-2-yl)spiro[2-benzofu ran-1,4'-piperidine]-1'-carboxamide
  • MW: 400.43 | Formula: C23H20N4O3
  • H donors: 1 H acceptors: 4 LogP: 2.43 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCC2(CC1)OC(=O)c1c2cccc1)Nc1cnc(cn1)c1ccccc1
  • InChi: 1S/C23H20N4O3/c28-21-17-8-4-5-9-18(17)23(30-21)10-12-27(13-11-23)22(29)26-20-15-24-19(14-25-20)16-6-2-1-3-7-16/h1-9,14-15H,10-13H2,(H,25,26,29)
  • InChiKey: MKVJQAZEXGSAIT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-oxo-N-(5-phenylpyrazin-2-yl)spiro[isobenzofuran-1,4'-piperidine]-1'-carboxamide
  • 3-oxo-N-(5-phenyl-2-pyrazinyl)-1'-spiro[isobenzofuran-1,4'-piperidine]carboxamide
  • 3-keto-N-(5-phenylpyrazin-2-yl)spiro[isobenzofuran-1,4'-piperidine]-1'-carboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens neuropeptide Y receptor Y5 Starlite/ChEMBL References
Homo sapiens neuropeptide Y receptor type 4-like Starlite/ChEMBL References
Mus musculus neuropeptide Y receptor Y5 Starlite/ChEMBL References
Homo sapiens neuropeptide Y receptor Y2 Starlite/ChEMBL References
Rattus norvegicus Neuropeptide Y receptor type 5 Starlite/ChEMBL References
Homo sapiens neuropeptide Y receptor Y1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K04209 neuropeptide Y receptor, invertebrate, putative Get druggable targets OG5_127863 All targets in OG5_127863
Schistosoma mansoni neuropeptide receptor Get druggable targets OG5_127863 All targets in OG5_127863
Echinococcus multilocularis neuropeptide receptor Get druggable targets OG5_127863 All targets in OG5_127863
Echinococcus granulosus neuropeptide receptor Get druggable targets OG5_127863 All targets in OG5_127863
Echinococcus multilocularis G protein coupled receptor 139 Get druggable targets OG5_127863 All targets in OG5_127863
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi follicle stimulating hormone receptor neuropeptide Y receptor type 4-like 375 aa 346 aa 23.1 %
Echinococcus multilocularis serotonin receptor Neuropeptide Y receptor type 5   445 aa 431 aa 21.3 %
Echinococcus multilocularis neuropeptides capa receptor Neuropeptide Y receptor type 5   445 aa 436 aa 20.2 %
Echinococcus granulosus biogenic amine 5HT receptor Neuropeptide Y receptor type 5   445 aa 420 aa 22.6 %
Schistosoma mansoni amine GPCR Neuropeptide Y receptor type 5   445 aa 435 aa 23.2 %
Echinococcus granulosus pyroglutamylated rfamide peptide receptor neuropeptide Y receptor Y2 381 aa 388 aa 20.4 %
Echinococcus multilocularis g protein coupled receptor Neuropeptide Y receptor type 5   445 aa 456 aa 22.6 %
Echinococcus granulosus g protein coupled receptor Neuropeptide Y receptor type 5   445 aa 455 aa 21.5 %
Schistosoma japonicum ko:K04207 neuropeptide Y receptor Y5, putative Neuropeptide Y receptor type 5   445 aa 376 aa 27.4 %
Schistosoma mansoni biogenic amine (5HT) receptor Neuropeptide Y receptor type 5   445 aa 420 aa 21.9 %
Echinococcus multilocularis g protein coupled receptor Neuropeptide Y receptor type 5   445 aa 432 aa 25.2 %
Brugia malayi follicle stimulating hormone receptor neuropeptide Y receptor Y1 384 aa 345 aa 22.0 %
Echinococcus granulosus g protein coupled receptor Neuropeptide Y receptor type 5   445 aa 431 aa 25.8 %
Onchocerca volvulus Neuropeptide Y receptor type 5   445 aa 415 aa 20.7 %
Onchocerca volvulus Neuropeptide Y receptor type 5   445 aa 401 aa 23.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0017 0.0022 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0657 0.0855
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0017 0.0022 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0017 0.0022 0.0029
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0021 0.0028
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus biogenic amine 5HT receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi Melatonin receptor type 1A 0.0017 0.0022 0.0001
Brugia malayi Dopamine receptor protein 1 0.0017 0.0022 0.0001
Schistosoma mansoni amine GPCR 0.0017 0.0022 0.0029
Echinococcus granulosus zinc finger protein 0.0021 0.0193 0.0224
Echinococcus multilocularis G protein coupled receptor 139 0.0202 0.7683 1
Schistosoma mansoni neuropeptide receptor 0.0017 0.0022 0.0029
Schistosoma mansoni neuropeptide F-like receptor 0.0017 0.0022 0.0029
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0017 0.0022 0.0001
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0017 0.0022 0.0001
Echinococcus granulosus neuropeptide receptor A26 0.0017 0.0022 0.0001
Brugia malayi putative neuropeptide receptor NPR1 0.0017 0.0022 0.0001
Trypanosoma brucei ISWI complex protein 0.0017 0 0.5
Schistosoma mansoni bromodomain containing protein 0.0069 0.2165 0.2819
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0051 0.1426 0.1857
Schistosoma mansoni biogenic amine (5HT) receptor 0.0017 0.0022 0.0029
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Brugia malayi Dopamine receptor protein 2 0.0017 0.0022 0.0001
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0017 0.0022 0.0001
Echinococcus multilocularis neuropeptides capa receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis g protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus granulosus g protein coupled receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus orexin receptor type 2 0.0017 0.0022 0.0001
Echinococcus granulosus biogenic amine 5HT receptor 0.0017 0.0022 0.0001
Schistosoma mansoni amine GPCR 0.0017 0.0022 0.0029
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0017 0.0022 0.0001
Brugia malayi AKH receptor 0.0017 0.0022 0.0001
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0017 0.0022 0.0029
Echinococcus multilocularis serotonin receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi Pre-SET motif family protein 0.0227 0.8702 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0047 0.1234 0.1397
Schistosoma mansoni histamine h1 receptor 0.0017 0.0022 0.0029
Schistosoma mansoni neuropeptide receptor 0.0017 0.0022 0.0029
Schistosoma mansoni myosin xvIII 0.0017 0.0022 0.0029
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0065 0.2004 0.2588
Brugia malayi Bromodomain containing protein 0.0042 0.1038 0.1171
Loa Loa (eye worm) neuropeptide F receptor 0.0017 0.0022 0.0001
Brugia malayi Serotonin receptor 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0077 0.2501 0.2857
Brugia malayi Calcitonin receptor-like protein seb-1 0.0054 0.1559 0.1772
Echinococcus granulosus tm gpcr rhodopsin 0.0017 0.0022 0.0001
Echinococcus multilocularis neuropeptide FF receptor 2 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis neuropeptide receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0227 0.8702 1
Echinococcus multilocularis neuropeptide s receptor 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni biogenic amine receptor 0.0017 0.0022 0.0029
Echinococcus granulosus neuropeptides capa receptor 0.0017 0.0022 0.0001
Schistosoma mansoni opsin-like receptor 0.0017 0.0022 0.0029
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Brugia malayi larval opioid receptor 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0017 0.0022 0.0001
Echinococcus granulosus g protein coupled receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0042 0.1041 0.1175
Loa Loa (eye worm) neuropeptide F receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) melatonin receptor type 1A 0.0017 0.0022 0.0001
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0019 0.0079 0.0075
Echinococcus multilocularis g protein coupled receptor 0.0017 0.0022 0.0001
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0327 0.0426
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0079 0.0103
Schistosoma mansoni amine GPCR 0.0017 0.0022 0.0029
Schistosoma mansoni adenoreceptor 0.0017 0.0022 0.0029
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi Pre-SET motif family protein 0.0033 0.0657 0.0732
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni opsin-like receptor 0.0017 0.0022 0.0029
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0065 0.2004 0.2588
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis fmrfamide receptor 0.0017 0.0022 0.0001
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0657 0.5
Echinococcus multilocularis neuropeptides capa receptor 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Trypanosoma cruzi ISWI complex protein 0.0017 0 0.5
Schistosoma mansoni neuropeptide receptor 0.0202 0.7683 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0017 0.0022 0.0001
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0017 0.0022 0.0029
Brugia malayi GnHR receptor homolog 0.0017 0.0022 0.0001
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0017 0.0022 0.0029
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Echinococcus granulosus neuropeptide Y receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0039 0.0931 0.1187
Echinococcus multilocularis fmrfamide receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0039 0.0931 0.1187
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0079 0.0103
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0327 0.0399
Leishmania major hypothetical protein, conserved 0.0017 0 0.5
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis somatostatin receptor 0.0017 0.0022 0.0001
Echinococcus granulosus g protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0017 0.0022 0.0001
Echinococcus multilocularis G-protein coupled receptor, putative 0.0017 0.0022 0.0001
Echinococcus granulosus histone lysine methyltransferase setb 0.0051 0.1426 0.1834
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) G-protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0017 0.0022 0.0001
Echinococcus granulosus peptide allatostatin:somatostatin 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0023 0.0241 0.0313
Brugia malayi Tachykinin-like peptides receptor 99D 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi G protein-coupled receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis neuropeptide Y receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni neuropeptide f receptor 76f 0.0017 0.0022 0.0029
Schistosoma mansoni alpha-1 adrenergic receptor 0.0017 0.0022 0.0029
Schistosoma mansoni biogenic amine receptor 0.0017 0.0022 0.0029
Schistosoma mansoni biogenic amine (5HT) receptor 0.0017 0.0022 0.0029
Brugia malayi follicle stimulating hormone receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis sex peptide receptor 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0017 0.0022 0.0001
Onchocerca volvulus 0.0033 0.0657 0.0636
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0054 0.1559 0.1772
Loa Loa (eye worm) bromodomain containing protein 0.0019 0.0107 0.0098
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Schistosoma mansoni amine GPCR 0.0017 0.0022 0.0029
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0017 0.0022 0.0001
Echinococcus granulosus dro:myosuppressin receptor 0.0017 0.0022 0.0001
Echinococcus granulosus hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus somatostatin receptor 0.0017 0.0022 0.0001
Echinococcus granulosus G protein coupled receptor 139 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0022 0.0029
Brugia malayi putative neuropeptide receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0657 0.0855
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0017 0.0022 0.0001
Schistosoma mansoni zinc finger protein 0.0021 0.0193 0.0251
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0017 0.0022 0.0001
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0017 0.0022 0.0029
Brugia malayi neuropeptide F receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni neuropeptide F-like receptor 0.0017 0.0022 0.0029
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0051 0.1426 0.1857
Schistosoma mansoni hypothetical protein 0.0017 0.0022 0.0029
Echinococcus granulosus 7TM GPCR rhodopsin 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0051 0.1426 0.1618
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0022 0.0029
Echinococcus multilocularis neuropeptide Y receptor 0.0017 0.0022 0.0001
Brugia malayi G protein-coupled receptor F59B2.13 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni neuropeptide receptor 0.0017 0.0022 0.0029
Echinococcus granulosus neuropeptide FF receptor 2 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis allatostatin A receptor 0.0017 0.0022 0.0001
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0017 0.0022 0.0029
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0327 0.0399
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0017 0.0022 0.0001
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0017 0.0022 0.0029
Brugia malayi Dopamine receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi latrophilin 2 splice variant baaae 0.0037 0.0848 0.0952
Echinococcus granulosus neuropeptide s receptor 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0017 0.0022 0.0029
Brugia malayi G-protein coupled receptor 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Echinococcus multilocularis neuropeptide receptor A26 0.0017 0.0022 0.0001
Schistosoma mansoni growth hormone secretagogue receptor 0.0017 0.0022 0.0029
Echinococcus granulosus tm gpcr rhodopsin 0.0017 0.0022 0.0001
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0051 0.1426 0.1834
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0607 0.0765
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0017 0.0022 0.0001
Echinococcus granulosus fmrfamide receptor 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0021 0.0028
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0017 0.0022 0.0029
Echinococcus multilocularis dro:myosuppressin receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0017 0.0022 0.0029
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0017 0.0022 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Brugia malayi neuropeptide F receptor 0.0017 0.0022 0.0001
Trichomonas vaginalis set domain proteins, putative 0.0258 1 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0054 0.1559 0.1772
Echinococcus multilocularis rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Echinococcus multilocularis serotonin receptor 0.0017 0.0022 0.0001
Echinococcus granulosus serotonin receptor 0.0017 0.0022 0.0001
Echinococcus granulosus methyl CpG binding domain protein 2 0.0019 0.0079 0.0075
Echinococcus granulosus neuropeptides capa receptor 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0021 0.0028
Schistosoma mansoni biogenic amine receptor 0.0017 0.0022 0.0029
Echinococcus granulosus 7tm_1 domain containing protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus tm gpcr rhodopsin 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0017 0.0022 0.0029
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis orexin receptor type 2 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0037 0.0848 0.0952
Echinococcus granulosus sex peptide receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi ORL1-like opioid receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) G-protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0017 0.0022 0.0001
Brugia malayi RE15519p 0.0017 0.0022 0.0001
Echinococcus granulosus tachykinin peptides receptor 99D 0.0017 0.0022 0.0001
Echinococcus multilocularis zinc finger protein 0.0021 0.0193 0.0224
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0017 0.0022 0.0001
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0017 0.0021 0.0028
Brugia malayi G-protein coupled receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0044 0.1148 0.1298
Loa Loa (eye worm) TYRA-2 protein 0.0017 0.0022 0.0001
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0657 0.0829
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0017 0.0022 0.0029
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni amine GPCR 0.0017 0.0022 0.0029
Brugia malayi Bromodomain containing protein 0.0082 0.2694 0.3079
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi Serotonin receptor 0.0017 0.0022 0.0001
Schistosoma mansoni hypothetical protein 0.0037 0.0848 0.1103
Echinococcus granulosus neuropeptide Y receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus neuropeptide receptor 0.0202 0.7683 1
Plasmodium vivax SET domain protein, putative 0.0033 0.0657 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0054 0.1559 0.1772
Echinococcus granulosus allatostatin A receptor 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0017 0.0022 0.0029
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0017 0.0022 0.0029
Echinococcus granulosus neuropeptide receptor 0.0017 0.0022 0.0001
Brugia malayi sulfakinin receptor protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Loa Loa (eye worm) hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi PHD-finger family protein 0.0027 0.0434 0.0475
Trypanosoma cruzi ISWI complex protein 0.0017 0 0.5
Schistosoma mansoni opsin-like receptor 0.0017 0.0022 0.0029
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0241 0.0253
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis g-protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0017 0.0022 0.0001
Echinococcus granulosus alpha 1A adrenergic receptor 0.0017 0.0022 0.0001
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus granulosus g-protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis g protein coupled receptor 0.0017 0.0022 0.0001
Echinococcus multilocularis neuropeptide receptor 0.0202 0.7683 1
Brugia malayi hypothetical protein 0.0017 0.0022 0.0001
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0017 0.0022 0.0001
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0017 0.0022 0.0001
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0017 0.0022 0.0001

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) Ex vivo receptor occupancy in high fat fed C57BL/6J mouse Lepr db/db model at 10 mg/kg, po for 16 hrs ChEMBL. 19464889
IC50 (binding) = 1.7 nM Displacement of [125I]PYY from rat NPY Y5 receptor ChEMBL. 19464889
IC50 (binding) = 1.7 nM Displacement of [125I]PYY from mouse NPY Y5 receptor ChEMBL. 19464889
IC50 (binding) = 2.4 nM Displacement of [125I]PYY from human recombinant NPY Y5 receptor expressed in mouse LMtk- cells ChEMBL. 19464889
IC50 (functional) = 6.1 nM Antagonist activity at human recombinant NPY Y5 receptor expressed in mouse LMtk- cells assessed as inhibition of NPY-induced Ca2+ increase ChEMBL. 19464889
IC50 (binding) > 10 uM Inhibition of human NPY Y1 receptor ChEMBL. 19464889
IC50 (binding) > 10 uM Inhibition of human NPY Y2 receptor ChEMBL. 19464889
IC50 (binding) > 10 uM Inhibition of human NPY Y4 receptor ChEMBL. 19464889
Ki (binding) = 2.4 nM Displacement of [125I]PYY from human recombinant neuropeptide Y5 receptor expressed in mouse LMtk- cells ChEMBL. 19459652

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

2 literature references were collected for this gene.

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