Detailed information for compound 268219

Basic information

Technical information
  • TDR Targets ID: 268219
  • Name: N,N-dimethyl-2-[[1-(3-phenylmethoxypyridin-2- yl)imidazol-2-yl]sulfinylmethyl]aniline
  • MW: 432.538 | Formula: C24H24N4O2S
  • H donors: 0 H acceptors: 3 LogP: 4.31 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][S+](c1nccn1c1ncccc1OCc1ccccc1)Cc1ccccc1N(C)C
  • InChi: 1S/C24H24N4O2S/c1-27(2)21-12-7-6-11-20(21)18-31(29)24-26-15-16-28(24)23-22(13-8-14-25-23)30-17-19-9-4-3-5-10-19/h3-16H,17-18H2,1-2H3
  • InChiKey: SILICMKBLHWUSI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[[1-(3-benzyloxy-2-pyridyl)imidazol-2-yl]sulfinylmethyl]-N,N-dimethyl-aniline
  • 2-[[1-(3-benzyloxy-2-pyridyl)-2-imidazolyl]sulfinylmethyl]-N,N-dimethylaniline
  • [2-[[1-(3-benzoxy-2-pyridyl)imidazol-2-yl]sulfinylmethyl]phenyl]-dimethyl-amine
  • N,N-dimethyl-2-[[1-[3-(phenylmethoxy)pyridin-2-yl]imidazol-2-yl]sulfinylmethyl]aniline
  • N,N-dimethyl-2-[[1-[3-(phenylmethoxy)-2-pyridyl]imidazol-2-yl]sulfinylmethyl]aniline
  • N,N-dimethyl-2-[[1-[3-(phenylmethoxy)-2-pyridyl]-2-imidazolyl]sulfinylmethyl]aniline
  • [2-[[1-[3-(benzyloxy)-2-pyridyl]imidazol-2-yl]sulfinylmethyl]phenyl]-dimethyl-amine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Sus scrofa Potassium-transporting ATPase 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
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 27.3 %
Echinococcus granulosus nervana 2 Potassium-transporting ATPase   290 aa 280 aa 29.3 %
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 266 aa 24.1 %
Onchocerca volvulus Glutamate carboxypeptidase 2 homolog Potassium-transporting ATPase   290 aa 301 aa 25.9 %
Schistosoma japonicum Sodium/potassium-transporting ATPase subunit beta-1, putative Potassium-transporting ATPase   290 aa 258 aa 24.4 %
Drosophila melanogaster nervana 1 Potassium-transporting ATPase   290 aa 305 aa 23.9 %
Schistosoma japonicum ko:K01540 Na+/K+-exchanging ATPase beta subunit [EC3.6.3.9B], putative Potassium-transporting ATPase   290 aa 258 aa 23.6 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 21.3 %
Echinococcus multilocularis nervana 2 Potassium-transporting ATPase   290 aa 280 aa 29.6 %
Echinococcus granulosus sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 266 aa 25.6 %
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 27.3 %
Loa Loa (eye worm) hypothetical protein Potassium-transporting ATPase   290 aa 301 aa 25.9 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 254 aa 23.6 %
Schistosoma japonicum Sodium/potassium-transporting ATPase subunit beta, putative Potassium-transporting ATPase   290 aa 256 aa 25.4 %
Echinococcus multilocularis nervana 2 Potassium-transporting ATPase   290 aa 265 aa 22.3 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 306 aa 26.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0017 0.0043 0.0033
Echinococcus granulosus neuropeptide s receptor 0.004 0.0204 0.0263
Leishmania major calcium-transporting ATPase, putative 0.0014 0.0019 0.0019
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.004 0.0204 0.0277
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0017 0.0043 0.0043
Onchocerca volvulus 0.004 0.0204 0.8602
Leishmania major calcium-translocating P-type ATPase 0.0017 0.0043 0.0043
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.004 0.0204 0.0194
Echinococcus multilocularis serotonin receptor 0.1067 0.737 1
Onchocerca volvulus 0.004 0.0204 0.8602
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis nervana 2 0.0026 0.0103 0.0126
Schistosoma mansoni neuropeptide receptor 0.004 0.0204 0.0194
Onchocerca volvulus 0.004 0.0204 0.8602
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0075 0.0445 0.1153
Echinococcus granulosus peptide allatostatin:somatostatin 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Entamoeba histolytica hypothetical protein 0.0059 0.0338 0.0774
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.1444 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.001 0.0014
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0564 0.3859 0.5229
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.0017 0.0043 0.0043
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0059
Loa Loa (eye worm) hypothetical protein 0.0048 0.0261 0.0355
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0014 0.0019 0.0051
Schistosoma mansoni amine GPCR 0.004 0.0204 0.0194
Echinococcus multilocularis neuropeptide receptor 0.004 0.0204 0.0263
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.1444 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus allatostatin A receptor 0.004 0.0204 0.0263
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Schistosoma mansoni sodium / potassium ATPase beta chain 0.0026 0.0103 0.0093
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0059
Onchocerca volvulus 0.004 0.0204 0.8602
Brugia malayi G protein-coupled receptor 0.004 0.0204 0.0204
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0072 0.0429 0.1012
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0025 0.0098 0.0098
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0075 0.0445 0.1153
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi Serotonin receptor 0.004 0.0204 0.0204
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0103 0.0093
Schistosoma mansoni hypothetical protein 0.004 0.0204 0.0194
Echinococcus granulosus sodium:potassium transporting ATPase subunit 0.0026 0.0103 0.0126
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0025 0.0098 0.0255
Echinococcus granulosus neuropeptide receptor 0.004 0.0204 0.0263
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0564 0.3859 0.5229
Brugia malayi putative neuropeptide receptor NPR1 0.004 0.0204 0.0204
Echinococcus multilocularis nervana 2 0.0026 0.0103 0.0126
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.0017 0.0043 0.0043
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0564 0.3859 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.004 0.0204 0.0263
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.0017 0.0043 0.0038
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0014 0.0019 0.0019
Echinococcus granulosus orexin receptor type 2 0.004 0.0204 0.0263
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0036 0.0176 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0075 0.0445 0.1052
Echinococcus multilocularis calcium transporting atpase 0.0014 0.0019 0.0013
Trypanosoma brucei calcium-translocating P-type ATPase 0.0014 0.0019 0.0019
Leishmania major dihydroorotate dehydrogenase 0.1444 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.004 0.0204 0.0194
Brugia malayi larval opioid receptor 0.004 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0017 0.0043 0.1521
Schistosoma mansoni neuropeptide f receptor 76f 0.004 0.0204 0.0194
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.004 0.0204 0.0277
Brugia malayi Serotonin receptor 0.004 0.0204 0.0204
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Echinococcus granulosus neuropeptide Y receptor 0.004 0.0204 0.0263
Schistosoma mansoni survival motor neuron protein 0.0044 0.023 0.022
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0017 0.0043 0.0043
Loa Loa (eye worm) transcription factor SMAD2 0.0093 0.0574 0.0779
Echinococcus multilocularis neuropeptide receptor 0.004 0.0204 0.0263
Echinococcus granulosus Na:K ATPase alpha subunit 0.0014 0.0019 0.0013
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.004 0.0204 0.0194
Brugia malayi Latrophilin receptor protein 2 0.0012 0.001 0.001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.004 0.0204 0.0263
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Onchocerca volvulus 0.004 0.0204 0.8602
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.014 0.0903 0.0894
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.0017 0.0043 0.0043
Echinococcus granulosus neuropeptide receptor A26 0.004 0.0204 0.0263
Brugia malayi neuropeptide F receptor 0.004 0.0204 0.0204
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0014 0.0019 0.0013
Schistosoma mansoni histamine h1 receptor 0.004 0.0204 0.0194
Echinococcus multilocularis survival motor neuron protein 1 0.0215 0.1424 0.1921
Echinococcus granulosus fmrfamide receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) follicle stimulating hormone receptor 0.004 0.0204 0.0277
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.0043 0.0112
Schistosoma mansoni biogenic amine receptor 0.004 0.0204 0.0194
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0044 0.023 0.023
Loa Loa (eye worm) hypothetical protein 0.0027 0.011 0.0149
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0017 0.0043 0.0045
Onchocerca volvulus 0.004 0.0204 0.8602
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Schistosoma mansoni biogenic amine receptor 0.004 0.0204 0.0194
Onchocerca volvulus 0.004 0.0204 0.8602
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.004 0.0204 0.0263
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0033 0.0155 0.0293
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.0012 0.0005 0.0007
Echinococcus granulosus tm gpcr rhodopsin 0.004 0.0204 0.0263
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0012 0.001 0.001
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.1444 1 1
Echinococcus granulosus sex peptide receptor 0.004 0.0204 0.0263
Brugia malayi putative neuropeptide receptor 0.004 0.0204 0.0204
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.0017 0.0043 0.0043
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis neuropeptide receptor A26 0.004 0.0204 0.0263
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.004 0.0204 0.0263
Echinococcus granulosus neuropeptide FF receptor 2 0.004 0.0204 0.0263
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.1444 1 1
Brugia malayi Dopamine receptor 0.004 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0075 0.0445 0.0445
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0014 0.0019 0.0009
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0564 0.3859 0.5229
Schistosoma mansoni amine GPCR 0.004 0.0204 0.0194
Onchocerca volvulus 0.004 0.0204 0.8602
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.0043 0.0112
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) neuropeptide F receptor 0.004 0.0204 0.0277
Echinococcus multilocularis G protein coupled receptor 139 0.004 0.0204 0.0263
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.1444 1 0.5
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0564 0.3859 1
Schistosoma mansoni ATPase 0.0017 0.0043 0.0033
Echinococcus granulosus thyrotropin releasing hormone receptor 0.004 0.0204 0.0263
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0017 0.0043 0.0043
Loa Loa (eye worm) neuropeptide F receptor 0.004 0.0204 0.0277
Loa Loa (eye worm) TYRA-2 protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.1444 1 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.004 0.0204 0.0263
Onchocerca volvulus 0.0026 0.0103 0.321
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.0043 0.0112
Echinococcus multilocularis neuropeptide Y receptor 0.004 0.0204 0.0263
Echinococcus granulosus g protein coupled receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) G-protein coupled receptor 0.004 0.0204 0.0277
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Onchocerca volvulus 0.0044 0.023 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0564 0.3859 1
Echinococcus granulosus neuropeptides capa receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.0026 0.0108 0.0146
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis g-protein coupled receptor 0.004 0.0204 0.0263
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.004 0.0204 0.0263
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0564 0.3859 0.5229
Brugia malayi hypothetical protein 0.0215 0.1424 0.1424
Schistosoma mansoni hypothetical protein 0.004 0.0204 0.0194
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0014 0.0019 0.0013
Echinococcus granulosus g protein coupled receptor 0.004 0.0204 0.0263
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis nervana 2 0.0026 0.0103 0.0126
Schistosoma mansoni transmemberane protein 0.0026 0.0103 0.0093
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.004 0.0204 0.0204
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.004 0.0204 0.0263
Schistosoma mansoni hypothetical protein 0.0044 0.023 0.022
Echinococcus granulosus calcium transporting ATPase type 2C member 0.0017 0.0043 0.0045
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.0017 0.0043 0.0045
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) G-protein coupled receptor 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.0215 0.1424 0.1932
Brugia malayi neuropeptide F receptor 0.004 0.0204 0.0204
Echinococcus granulosus g protein coupled receptor 0.004 0.0204 0.0263
Brugia malayi Tachykinin-like peptides receptor 99D 0.004 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.004 0.0204 0.0194
Echinococcus multilocularis neuropeptides capa receptor 0.004 0.0204 0.0263
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0564 0.3859 1
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0017 0.0043 0.0059
Brugia malayi Dopamine receptor protein 2 0.004 0.0204 0.0204
Plasmodium falciparum dihydroorotate dehydrogenase 0.1444 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.004 0.0204 0.0194
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.004 0.0204 0.0194
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0014 0.0019 0.0019
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.0017 0.0043 0.0045
Loa Loa (eye worm) hypothetical protein 0.1067 0.737 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) hypothetical protein 0.0039 0.0196 0.0265
Echinococcus multilocularis g protein coupled receptor 0.004 0.0204 0.0263
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.004 0.0204 0.0263
Echinococcus granulosus tm gpcr rhodopsin 0.004 0.0204 0.0263
Echinococcus granulosus serotonin receptor 0.004 0.0204 0.0263
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.004 0.0204 0.0263
Echinococcus multilocularis neuropeptide FF receptor 2 0.004 0.0204 0.0263
Schistosoma mansoni growth hormone secretagogue receptor 0.004 0.0204 0.0194
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.004 0.0204 0.0204
Brugia malayi Melatonin receptor type 1A 0.004 0.0204 0.0204
Schistosoma mansoni opsin-like receptor 0.004 0.0204 0.0194
Echinococcus granulosus nervana 2 0.0026 0.0103 0.0126
Echinococcus granulosus biogenic amine 5HT receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi Zinc finger, C2H2 type family protein 0.0564 0.3859 0.3859
Echinococcus multilocularis neuropeptide s receptor 0.004 0.0204 0.0263
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Brugia malayi Na,K-ATPase alpha subunit 0.0017 0.0043 0.0043
Trypanosoma brucei calcium motive p-type ATPase, putative 0.0014 0.0019 0.0019
Echinococcus multilocularis allatostatin A receptor 0.004 0.0204 0.0263
Schistosoma mansoni biogenic amine (5HT) receptor 0.1067 0.737 0.7367
Schistosoma mansoni amine GPCR 0.004 0.0204 0.0194
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0017 0.0043 0.0045
Echinococcus multilocularis serotonin receptor 0.1067 0.737 1
Brugia malayi sulfakinin receptor protein 0.004 0.0204 0.0204
Loa Loa (eye worm) melatonin receptor type 1A 0.004 0.0204 0.0277
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.0017 0.0043 0.0043
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0075 0.0445 0.1153
Leishmania major P-type ATPase, putative 0.0014 0.0019 0.0019
Brugia malayi AKH receptor 0.004 0.0204 0.0204
Onchocerca volvulus 0.004 0.0204 0.8602
Echinococcus multilocularis biogenic amine (5HT) receptor 0.004 0.0204 0.0263
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.1444 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0204 0.0194
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0048 0.0261 0.0341
Schistosoma mansoni opsin-like receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.0043 0.0112
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.0043 0.0112
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.0043 0.0112
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.0012 0.0005 0.0005
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0014 0.0019 0.0013
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.014 0.0903 0.1213
Schistosoma mansoni hypothetical protein 0.0027 0.011 0.01
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0014 0.0019 0.0009
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Brugia malayi G protein-coupled receptor F59B2.13 0.004 0.0204 0.0204
Echinococcus granulosus tachykinin peptides receptor 99D 0.004 0.0204 0.0263
Onchocerca volvulus Neuropeptide F receptor homolog 0.004 0.0204 0.8602
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0564 0.3859 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus multilocularis g protein coupled receptor 0.004 0.0204 0.0263
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0014 0.0019 0.0009
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.1444 1 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.004 0.0204 0.0263
Brugia malayi Dopamine receptor protein 1 0.004 0.0204 0.0204
Echinococcus multilocularis nervana 2 0.0026 0.0103 0.0126
Onchocerca volvulus 0.004 0.0204 0.8602
Echinococcus granulosus calcium transporting atpase 0.0014 0.0019 0.0013
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.004 0.0204 0.0204
Schistosoma mansoni neuropeptide F-like receptor 0.004 0.0204 0.0194
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.0043 0.0112
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Brugia malayi gonadotropin-releasing hormone receptor 2 0.004 0.0204 0.0204
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0017 0.0043 0.0043
Echinococcus granulosus nervana 2 0.0026 0.0103 0.0126
Schistosoma mansoni biogenic amine receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) hypothetical protein 0.0026 0.0103 0.014
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.0017 0.0043 0.0045
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0564 0.3859 1
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0014 0.0019 0.0019
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Echinococcus multilocularis dro:myosuppressin receptor 0.004 0.0204 0.0263
Brugia malayi G-protein coupled receptor 0.004 0.0204 0.0204
Echinococcus granulosus dro:myosuppressin receptor 0.004 0.0204 0.0263
Echinococcus multilocularis g protein coupled receptor 0.004 0.0204 0.0263
Onchocerca volvulus 0.004 0.0204 0.8602
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0103 0.0093
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.1444 1 1
Echinococcus granulosus hypothetical protein 0.004 0.0204 0.0263
Echinococcus multilocularis sodium:potassium transporting ATPase subunit 0.0026 0.0103 0.0126
Onchocerca volvulus 0.004 0.0204 0.8602
Onchocerca volvulus 0.004 0.0204 0.8602
Schistosoma mansoni amine GPCR 0.004 0.0204 0.0194
Echinococcus granulosus 7tm_1 domain containing protein 0.004 0.0204 0.0263
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.004 0.0204 0.0263
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0014 0.0019 0.0009
Echinococcus granulosus 7TM GPCR rhodopsin 0.004 0.0204 0.0263
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0075 0.0445 0.0445
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.1444 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Loa Loa (eye worm) phosphatidylinositol 3 0.0023 0.0083 0.0113
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.0017 0.0043 0.0112
Brugia malayi MH2 domain containing protein 0.0093 0.0574 0.0574
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi GnHR receptor homolog 0.004 0.0204 0.0204
Schistosoma mansoni neuropeptide F-like receptor 0.004 0.0204 0.0194
Schistosoma mansoni ATPase 0.0017 0.0043 0.0033
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0066 0.0383 0.0383
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0014 0.0019 0.0013
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0051 0.0282 0.073
Echinococcus multilocularis orexin receptor type 2 0.004 0.0204 0.0263
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0014 0.0019 0.0009
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0014 0.0019 0.0013
Schistosoma mansoni neuropeptide receptor 0.004 0.0204 0.0194
Brugia malayi G-protein coupled receptor 0.004 0.0204 0.0204
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0014 0.0019 0.0009
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0025 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.0017 0.0043 0.0024
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.004 0.0204 0.0277
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.004 0.0204 0.0194
Echinococcus multilocularis neuropeptides capa receptor 0.004 0.0204 0.0263
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Schistosoma mansoni hypothetical protein 0.004 0.0204 0.0194
Brugia malayi latrophilin 2 splice variant baaae 0.0027 0.011 0.011
Echinococcus multilocularis somatostatin receptor 0.004 0.0204 0.0263
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0025 0.0098 0.0145
Echinococcus multilocularis neuropeptide Y receptor 0.004 0.0204 0.0263
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0564 0.3859 0.3859
Schistosoma mansoni hypothetical protein 0.004 0.0204 0.0194
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0103 0.0093
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.004 0.0204 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Schistosoma mansoni amine GPCR 0.004 0.0204 0.0194
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.004 0.0204 0.8602
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.004 0.0204 0.0263
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0025 0.0098 0.0145
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0014 0.0019 0.0019
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0059 0.0338 0.0774
Schistosoma mansoni biogenic amine (5HT) receptor 0.004 0.0204 0.0194
Loa Loa (eye worm) latrophilin receptor protein 2 0.0012 0.001 0.0014
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0564 0.3859 1
Echinococcus multilocularis fmrfamide receptor 0.004 0.0204 0.0263
Onchocerca volvulus 0.0026 0.0103 0.321
Echinococcus granulosus neuropeptides capa receptor 0.004 0.0204 0.0263
Schistosoma mansoni alpha-1 adrenergic receptor 0.004 0.0204 0.0194
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0025 0.0098 0.0255
Brugia malayi Membrane calcium atpase protein 3 0.0014 0.0019 0.0019
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0025 0.0098 0.0098
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0051 0.0282 0.073
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Brugia malayi follicle stimulating hormone receptor 0.004 0.0204 0.0204
Schistosoma mansoni neuropeptide receptor 0.004 0.0204 0.0194
Onchocerca volvulus 0.004 0.0204 0.8602
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.0043 0.0112
Loa Loa (eye worm) phosphatidylinositol 3 0.0125 0.0797 0.1081
Brugia malayi ORL1-like opioid receptor 0.004 0.0204 0.0204
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus biogenic amine 5HT receptor 0.1067 0.737 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0048 0.0261 0.0261
Echinococcus granulosus neuropeptide Y receptor 0.004 0.0204 0.0263
Onchocerca volvulus 0.004 0.0204 0.8602
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Schistosoma mansoni dihydroorotate dehydrogenase 0.1444 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.004 0.0204 0.0263
Echinococcus multilocularis rhodopsin orphan GPCR 0.004 0.0204 0.0263
Loa Loa (eye worm) MH2 domain-containing protein 0.0093 0.0574 0.0779
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.1444 1 1
Loa Loa (eye worm) hypothetical protein 0.1067 0.737 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.004 0.0204 0.0194
Echinococcus granulosus nervana 2 0.0026 0.0103 0.0126
Brugia malayi Serotonin/octopamine receptor family protein 7 0.004 0.0204 0.0204
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.0017 0.0043 0.0038
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Echinococcus multilocularis G-protein coupled receptor, putative 0.004 0.0204 0.0263
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0017 0.0046 0.1704
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.004 0.0204 0.0263
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0204 0.0194
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0048 0.0261 0.0341
Brugia malayi Calcitonin receptor-like protein seb-1 0.0039 0.0196 0.0196
Schistosoma mansoni neuropeptide receptor 0.004 0.0204 0.0194
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0017 0.0043 0.0043
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0025 0.0098 0.0255
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.004 0.0204 0.0263
Onchocerca volvulus 0.004 0.0204 0.8602
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus g-protein coupled receptor 0.004 0.0204 0.0263
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0025 0.0098 0.0088
Loa Loa (eye worm) hypothetical protein 0.0026 0.0103 0.014
Echinococcus granulosus nervana 2 0.0026 0.0103 0.0126
Echinococcus granulosus neuropeptide receptor 0.004 0.0204 0.0263
Echinococcus granulosus somatostatin receptor 0.004 0.0204 0.0263
Brugia malayi RE15519p 0.004 0.0204 0.0204
Schistosoma mansoni myosin xvIII 0.004 0.0204 0.0194
Echinococcus granulosus alpha 1A adrenergic receptor 0.004 0.0204 0.0263
Echinococcus granulosus tm gpcr rhodopsin 0.004 0.0204 0.0263
Echinococcus multilocularis sex peptide receptor 0.004 0.0204 0.0263
Brugia malayi hypothetical protein 0.004 0.0204 0.0204
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0023 0.0083 0.0083
Schistosoma mansoni adenoreceptor 0.004 0.0204 0.0194
Echinococcus granulosus survival motor neuron protein 1 0.0215 0.1424 0.1921
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.004 0.0204 0.0194
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0075 0.0445 0.0445
Echinococcus granulosus G protein coupled receptor 139 0.004 0.0204 0.0263
Leishmania major calcium motive p-type ATPase, putative 0.0014 0.0019 0.0019
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0103 0.0126
Toxoplasma gondii P-type ATPase4, putative 0.0017 0.0043 0.0043
Loa Loa (eye worm) hypothetical protein 0.004 0.0204 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.004 0.0204 0.0263
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0039 0.0196 0.0196
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0039 0.0196 0.0265
Schistosoma mansoni opsin-like receptor 0.004 0.0204 0.0194
Echinococcus multilocularis fmrfamide receptor 0.004 0.0204 0.0263
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.014 0.0903 0.1213
Onchocerca volvulus 0.004 0.0204 0.8602

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 16 uM In vitro inhibition against H+/K+ ATPase from porcine gastric mucosal membrane vesicles ChEMBL. 8558532
IC50 (binding) = 16 uM In vitro inhibition against H+/K+ ATPase from porcine gastric mucosal membrane vesicles ChEMBL. 8558532
Inhibition (functional) = 34 % Gastric antisecretory activity was tested in rats at 30 mg/kg, po expressed as the percentage of inhibition against the acid output of the control group ChEMBL. 8558532
Inhibition (functional) = 34 % Gastric antisecretory activity was tested in rats at 30 mg/kg, po expressed as the percentage of inhibition against the acid output of the control group ChEMBL. 8558532

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

1 literature reference was collected for this gene.

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