Detailed information for compound 1405852

Basic information

Technical information
  • TDR Targets ID: 1405852
  • Name: T5325758
  • MW: 338.427 | Formula: C18H18N4OS
  • H donors: 0 H acceptors: 3 LogP: 2.92 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: O1CCN(CC1)c1nc(nc2c1c1CCCc1s2)c1cccnc1
  • InChi: 1S/C18H18N4OS/c1-4-13-14(5-1)24-18-15(13)17(22-7-9-23-10-8-22)20-16(21-18)12-3-2-6-19-11-12/h2-3,6,11H,1,4-5,7-10H2
  • InChiKey: IFVZCXHHEXHVTO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • MLS000772255
  • SMR000344355
  • ZINC05261960

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific demethylase 4E Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens sphingomyelin phosphodiesterase 1, acid lysosomal Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative Get druggable targets OG5_128629 All targets in OG5_128629
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative Get druggable targets OG5_128629 All targets in OG5_128629
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128629 All targets in OG5_128629
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans one of four genes similar to C. elegans asm2 lysosomal acid sphingomyelin phosphodiesterase (XL940) Get druggable targets OG5_128629 All targets in OG5_128629
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.5063 0.4867
Brugia malayi putative neuropeptide receptor 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni opsin-like receptor 0.0023 0.0391 0.0014
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Onchocerca volvulus 0.0023 0.0391 0.5
Entamoeba histolytica hypothetical protein 0.0043 0.2971 0.2692
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0023 0.0391 0.0014
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0382 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Onchocerca volvulus 0.0023 0.0391 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Onchocerca volvulus 0.0023 0.0391 0.5
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus allatostatin A receptor 0.0023 0.0391 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.003 0.1347 0.1003
Schistosoma mansoni histamine h1 receptor 0.0023 0.0391 0.0014
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptides capa receptor 0.0023 0.0391 0.0014
Schistosoma mansoni jumonji/arid domain-containing protein 0.0071 0.6415 0.8982
Echinococcus granulosus dro:myosuppressin receptor 0.0023 0.0391 0.0014
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.2971 0.3855
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0023 0.0391 0.0014
Echinococcus granulosus biogenic amine 5HT receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus neuropeptide receptor 0.0023 0.0391 0.0014
Schistosoma mansoni hypothetical protein 0.0023 0.0391 0.0014
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.7098 0.6983
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0391 0.0014
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus tar DNA binding protein 0.0076 0.7098 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0023 0.0391 0.0014
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni jumonji domain containing protein 0.0071 0.6415 0.8982
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Echinococcus multilocularis somatostatin receptor 0.0023 0.0391 0.0014
Schistosoma mansoni neuropeptide F-like receptor 0.0023 0.0391 0.0014
Echinococcus granulosus orexin receptor type 2 0.0023 0.0391 0.0014
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0023 0.0391 0.0014
Entamoeba histolytica hypothetical protein 0.0043 0.2971 0.2692
Brugia malayi Melatonin receptor type 1A 0.0023 0.0391 0.0551
Brugia malayi hypothetical protein 0.003 0.1347 0.1898
Onchocerca volvulus 0.0023 0.0391 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) G-protein coupled receptor 0.0023 0.0391 0.001
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.6702 1
Brugia malayi GnHR receptor homolog 0.0023 0.0391 0.0551
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0023 0.0391 0.001
Echinococcus granulosus alpha 1A adrenergic receptor 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis G-protein coupled receptor, putative 0.0023 0.0391 0.0014
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.6702 1
Brugia malayi RNA binding protein 0.0076 0.7098 1
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.1347 1
Echinococcus granulosus neuropeptide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0023 0.0391 0.0014
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.2685 0.3782
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine receptor 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0391 0.0014
Brugia malayi larval opioid receptor 0.0023 0.0391 0.0551
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0023 0.0391 0.5
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Echinococcus granulosus g protein coupled receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni hypothetical protein 0.0023 0.0391 0.0014
Brugia malayi Dopamine receptor protein 2 0.0023 0.0391 0.0551
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.6702 0.941
Brugia malayi Dopamine receptor 0.0023 0.0391 0.0551
Schistosoma mansoni neuropeptide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) TAR-binding protein 0.0076 0.7098 0.6983
Echinococcus multilocularis orexin receptor type 2 0.0023 0.0391 0.0014
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0382 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.6702 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis lysine specific demethylase 5A 0.0071 0.6415 0.8982
Onchocerca volvulus 0.0023 0.0391 0.5
Echinococcus multilocularis sex peptide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0023 0.0391 0.0014
Brugia malayi Dopamine receptor protein 1 0.0023 0.0391 0.0551
Schistosoma mansoni alpha-1 adrenergic receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis G protein coupled receptor 139 0.0023 0.0391 0.0014
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Echinococcus granulosus somatostatin receptor 0.0023 0.0391 0.0014
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0382 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni amine GPCR 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Onchocerca volvulus 0.0023 0.0391 0.5
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0071 0.6415 0.8982
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0023 0.0391 0.0014
Echinococcus granulosus neuropeptide Y receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis dro:myosuppressin receptor 0.0023 0.0391 0.0014
Brugia malayi neuropeptide F receptor 0.0023 0.0391 0.0551
Echinococcus granulosus serotonin receptor 0.0023 0.0391 0.0014
Echinococcus granulosus 7TM GPCR rhodopsin 0.0023 0.0391 0.0014
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.5063 0.7133
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0023 0.0391 0.0014
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptides capa receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0023 0.0391 0.0014
Echinococcus granulosus g protein coupled receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptide receptor 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 0.7098 1
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) TYRA-2 protein 0.0023 0.0391 0.001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.5063 0.7133
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Echinococcus granulosus lysine specific demethylase 5A 0.0071 0.6415 0.8982
Onchocerca volvulus 0.0023 0.0391 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni amine GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni jumonji/arid domain-containing protein 0.0071 0.6415 0.8982
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0382 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) melatonin receptor type 1A 0.0023 0.0391 0.001
Echinococcus granulosus neuropeptide Y receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptide receptor 0.0023 0.0391 0.0014
Echinococcus granulosus neuropeptides capa receptor 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine (5HT) receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Onchocerca volvulus Neuropeptide F receptor homolog 0.0023 0.0391 0.5
Echinococcus multilocularis fmrfamide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0391 0.0014
Loa Loa (eye worm) jmjC domain-containing protein 0.0071 0.6415 0.6272
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.7098 1
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni amine GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.6702 0.941
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0023 0.0391 0.0551
Loa Loa (eye worm) neuropeptide F receptor 0.0023 0.0391 0.001
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.1347 1
Schistosoma mansoni biogenic amine receptor 0.0023 0.0391 0.0014
Brugia malayi TAR-binding protein 0.0076 0.7098 1
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Loa Loa (eye worm) G-protein coupled receptor 0.0023 0.0391 0.001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Echinococcus granulosus 7tm_1 domain containing protein 0.0023 0.0391 0.0014
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0023 0.0391 0.0014
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.6702 0.941
Echinococcus granulosus fmrfamide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus multilocularis serotonin receptor 0.0023 0.0391 0.0014
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.1347 0.1527
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.1347 1
Brugia malayi follicle stimulating hormone receptor 0.0023 0.0391 0.0551
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0023 0.0391 0.001
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni neuropeptide f receptor 76f 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus multilocularis g-protein coupled receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0023 0.0391 0.001
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0023 0.0391 0.0014
Brugia malayi sulfakinin receptor protein 0.0023 0.0391 0.0551
Echinococcus multilocularis neuropeptide FF receptor 2 0.0023 0.0391 0.0014
Echinococcus granulosus sex peptide receptor 0.0023 0.0391 0.0014
Schistosoma mansoni neuropeptide receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis allatostatin A receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis serotonin receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni tar DNA-binding protein 0.0076 0.7098 1
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni growth hormone secretagogue receptor 0.0023 0.0391 0.0014
Echinococcus granulosus g protein coupled receptor 0.0023 0.0391 0.0014
Schistosoma mansoni adenoreceptor 0.0023 0.0391 0.0014
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0023 0.0391 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Brugia malayi G-protein coupled receptor 0.0023 0.0391 0.0551
Brugia malayi neuropeptide F receptor 0.0023 0.0391 0.0551
Schistosoma mansoni hypothetical protein 0.0043 0.2971 0.3855
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) neuropeptide F receptor 0.0023 0.0391 0.001
Schistosoma mansoni tar DNA-binding protein 0.0076 0.7098 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.2971 0.3855
Echinococcus granulosus G protein coupled receptor 139 0.0023 0.0391 0.0014
Echinococcus granulosus tachykinin peptides receptor 99D 0.0023 0.0391 0.0014
Loa Loa (eye worm) RNA binding protein 0.0076 0.7098 0.6983
Schistosoma mansoni amine GPCR 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.6702 0.941
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni biogenic amine (5HT) receptor 0.0023 0.0391 0.0014
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni hypothetical protein 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Entamoeba histolytica hypothetical protein 0.0043 0.2971 0.2692
Brugia malayi jmjC domain containing protein 0.0071 0.6415 0.9037
Brugia malayi G-protein coupled receptor 0.0023 0.0391 0.0551
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Schistosoma mansoni myosin xvIII 0.0023 0.0391 0.0014
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0382 0.5
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0023 0.0391 0.0014
Echinococcus granulosus biogenic amine 5HT receptor 0.0023 0.0391 0.0014
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0023 0.0391 0.0551
Schistosoma mansoni neuropeptide receptor 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0023 0.0391 0.0014
Schistosoma mansoni hypothetical protein 0.0041 0.2685 0.3429
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni opsin-like receptor 0.0023 0.0391 0.0014
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.6702 1
Brugia malayi G protein-coupled receptor 0.0023 0.0391 0.0551
Schistosoma mansoni hypothetical protein 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.1347 1
Echinococcus multilocularis tar DNA binding protein 0.0076 0.7098 1
Brugia malayi RE15519p 0.0023 0.0391 0.0551
Echinococcus multilocularis neuropeptide receptor A26 0.0023 0.0391 0.0014
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0041 0.2685 0.2394
Brugia malayi ORL1-like opioid receptor 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.006 0.5063 0.4867
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0023 0.0391 0.0551
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0023 0.0391 0.0014
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0023 0.0391 0.0014
Echinococcus multilocularis fmrfamide receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptide Y receptor 0.0023 0.0391 0.0014
Entamoeba histolytica hypothetical protein 0.0043 0.2971 0.2692
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0391 0.0014
Echinococcus granulosus g-protein coupled receptor 0.0023 0.0391 0.0014
Echinococcus granulosus neuropeptide FF receptor 2 0.0023 0.0391 0.0014
Echinococcus multilocularis neuropeptide Y receptor 0.0023 0.0391 0.0014
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0023 0.0391 0.0014
Brugia malayi Serotonin receptor 0.0023 0.0391 0.0551
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Echinococcus granulosus neuropeptides capa receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Onchocerca volvulus 0.0023 0.0391 0.5
Brugia malayi Tachykinin-like peptides receptor 99D 0.0023 0.0391 0.0551
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi G protein-coupled receptor F59B2.13 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus granulosus neuropeptide s receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0391 0.0014
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.6702 1
Echinococcus multilocularis neuropeptide s receptor 0.0023 0.0391 0.0014
Echinococcus granulosus neuropeptide receptor A26 0.0023 0.0391 0.0014
Echinococcus granulosus hypothetical protein 0.0023 0.0391 0.0014
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.2971 0.3855
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Schistosoma mansoni neuropeptide receptor 0.0023 0.0391 0.0014
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Leishmania major hypothetical protein, conserved 0.003 0.1347 0.1527
Brugia malayi hypothetical protein 0.0023 0.0391 0.0551
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0023 0.0391 0.0014
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0023 0.0391 0.0014
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.6702 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.7098 1
Brugia malayi Serotonin receptor 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi hypothetical protein 0.0043 0.2971 0.4186
Schistosoma mansoni tar DNA-binding protein 0.0076 0.7098 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0391 0.0014
Onchocerca volvulus 0.0023 0.0391 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.1347 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0391 0.0014
Echinococcus granulosus peptide allatostatin:somatostatin 0.0023 0.0391 0.0014
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0023 0.0391 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0391 0.0014
Brugia malayi jmjC domain containing protein 0.0071 0.6415 0.9037
Schistosoma mansoni neuropeptide F-like receptor 0.0023 0.0391 0.0014
Schistosoma mansoni opsin-like receptor 0.0023 0.0391 0.0014
Brugia malayi AKH receptor 0.0023 0.0391 0.0551
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0071 0.6415 0.8982
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0382 0.0538
Brugia malayi putative neuropeptide receptor NPR1 0.0023 0.0391 0.0551
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.1347 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0391 0.001
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0023 0.0391 0.0551
Schistosoma mansoni amine GPCR 0.0023 0.0391 0.0014
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0023 0.0391 0.0014

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.92 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 1.3115 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 2.2387 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.0795 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.9433 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.2753 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. Inhibitors of Secretory Acid Sphingomyelinase (S-ASM): qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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