Detailed information for compound 1486945

Basic information

Technical information
  • TDR Targets ID: 1486945
  • Name: N-cyclopentyl-2-[[5-[(2,6-dioxo-3H-pyrimidin- 4-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol -3-yl]sulfanyl]acetamide
  • MW: 444.483 | Formula: C20H21FN6O3S
  • H donors: 3 H acceptors: 7 LogP: 2.87 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NC1CCCC1)CSc1nnc(n1c1ccc(cc1)F)Cc1cc(O)nc(n1)O
  • InChi: 1S/C20H21FN6O3S/c21-12-5-7-15(8-6-12)27-16(9-14-10-17(28)24-19(30)23-14)25-26-20(27)31-11-18(29)22-13-3-1-2-4-13/h5-8,10,13H,1-4,9,11H2,(H,22,29)(H2,23,24,28,30)
  • InChiKey: FBMAPIXEWNPNOO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-cyclopentyl-2-[[5-[(2,6-dioxo-3H-pyrimidin-4-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]acetamide
  • N-cyclopentyl-2-[[5-[(2,6-diketo-3H-pyrimidin-4-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]acetamide
  • N-cyclopentyl-2-[[5-[(2,6-dioxo-3H-pyrimidin-4-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide
  • MLS000117343
  • SMR000094293

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein 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
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease 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
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 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
Trichomonas vaginalis ap endonuclease, putative 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 japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 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
Leishmania donovani apurinic/apyrimidinic endonuclease-redox 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
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative 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
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative 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
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 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
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), 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
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0072 0.0429 1
Schistosoma mansoni amine GPCR 0.0072 0.0429 1
Echinococcus granulosus hypothetical protein 0.0072 0.0429 1
Brugia malayi Melatonin receptor type 1A 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Trichomonas vaginalis ap endonuclease, putative 0.0023 0 0.5
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0072 0.0429 1
Brugia malayi putative neuropeptide receptor NPR1 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0072 0.0429 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0072 0.0429 1
Brugia malayi follicle stimulating hormone receptor 0.0072 0.0429 1
Echinococcus granulosus somatostatin receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0 0.5
Echinococcus multilocularis g protein coupled receptor 0.0072 0.0429 1
Echinococcus granulosus neuropeptide Y receptor 0.0072 0.0429 1
Brugia malayi AKH receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus neuropeptide s receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi G protein-coupled receptor 0.0072 0.0429 1
Echinococcus granulosus neuropeptides capa receptor 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0072 0.0429 1
Schistosoma mansoni hypothetical protein 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus granulosus neuropeptides capa receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0 0.5
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus granulosus G protein coupled receptor 139 0.0072 0.0429 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0 0.5
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0 0.5
Echinococcus multilocularis neuropeptide s receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni adenoreceptor 0.0072 0.0429 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0072 0.0429 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0072 0.0429 1
Brugia malayi Serotonin receptor 0.0072 0.0429 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0072 0.0429 1
Echinococcus granulosus tm gpcr rhodopsin 0.0072 0.0429 1
Schistosoma mansoni opsin-like receptor 0.0072 0.0429 1
Echinococcus granulosus g-protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Brugia malayi hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) G-protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus tm gpcr rhodopsin 0.0072 0.0429 1
Echinococcus granulosus dro:myosuppressin receptor 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni opsin-like receptor 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus orexin receptor type 2 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni myosin xvIII 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.0072 0.0429 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide Y receptor 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Schistosoma mansoni hypothetical protein 0.0072 0.0429 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0 0.5
Onchocerca volvulus 0.0072 0.0429 0.5
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Trichomonas vaginalis ap endonuclease, putative 0.0023 0 0.5
Echinococcus multilocularis g-protein coupled receptor 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus allatostatin A receptor 0.0072 0.0429 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0072 0.0429 1
Loa Loa (eye worm) TYRA-2 protein 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0072 0.0429 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Brugia malayi G-protein coupled receptor 0.0072 0.0429 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.0072 0.0429 0.5
Brugia malayi putative neuropeptide receptor 0.0072 0.0429 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.0072 0.0429 1
Brugia malayi ORL1-like opioid receptor 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0072 0.0429 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus neuropeptide Y receptor 0.0072 0.0429 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0 0.5
Schistosoma mansoni hypothetical protein 0.0072 0.0429 1
Brugia malayi Dopamine receptor protein 1 0.0072 0.0429 1
Loa Loa (eye worm) G-protein coupled receptor 0.0072 0.0429 1
Brugia malayi G-protein coupled receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide receptor 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide receptor A26 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Echinococcus multilocularis serotonin receptor 0.0072 0.0429 1
Brugia malayi neuropeptide F receptor 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0072 0.0429 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0072 0.0429 1
Echinococcus multilocularis fmrfamide receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide receptor 0.0072 0.0429 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0072 0.0429 1
Mycobacterium ulcerans 3-dehydroquinate dehydratase 0.1172 1 1
Schistosoma mansoni amine GPCR 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis neuropeptides capa receptor 0.0072 0.0429 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0072 0.0429 1
Brugia malayi GnHR receptor homolog 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide F-like receptor 0.0072 0.0429 1
Mycobacterium tuberculosis 3-dehydroquinate dehydratase AroD (AROQ) (3-dehydroquinase) (type II dhqase) 0.1172 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni amine GPCR 0.0072 0.0429 1
Echinococcus multilocularis sex peptide receptor 0.0072 0.0429 1
Brugia malayi Dopamine receptor 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Echinococcus granulosus fmrfamide receptor 0.0072 0.0429 1
Echinococcus granulosus neuropeptide receptor A26 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0072 0.0429 1
Echinococcus granulosus 7tm_1 domain containing protein 0.0072 0.0429 1
Echinococcus granulosus g protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis g protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus serotonin receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide receptor 0.0072 0.0429 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0072 0.0429 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus multilocularis orexin receptor type 2 0.0072 0.0429 1
Echinococcus granulosus sex peptide receptor 0.0072 0.0429 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0072 0.0429 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0072 0.0429 1
Schistosoma mansoni amine GPCR 0.0072 0.0429 1
Brugia malayi Dopamine receptor protein 2 0.0072 0.0429 1
Schistosoma mansoni biogenic amine receptor 0.0072 0.0429 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.0072 0.0429 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0072 0.0429 1
Schistosoma mansoni histamine h1 receptor 0.0072 0.0429 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide Y receptor 0.0072 0.0429 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0072 0.0429 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Schistosoma mansoni growth hormone secretagogue receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0072 0.0429 1
Echinococcus multilocularis G protein coupled receptor 139 0.0072 0.0429 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0072 0.0429 1
Echinococcus granulosus neuropeptide receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0072 0.0429 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0072 0.0429 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0072 0.0429 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Brugia malayi neuropeptide F receptor 0.0072 0.0429 1
Brugia malayi larval opioid receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0072 0.0429 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0 0.5
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0 0.5
Brugia malayi hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Toxoplasma gondii exonuclease III APE 0.0023 0 0.5
Brugia malayi Serotonin receptor 0.0072 0.0429 1
Echinococcus multilocularis g protein coupled receptor 0.0072 0.0429 1
Echinococcus granulosus g protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) neuropeptide F receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0072 0.0429 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0072 0.0429 1
Echinococcus granulosus neuropeptide FF receptor 2 0.0072 0.0429 1
Echinococcus multilocularis somatostatin receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Schistosoma mansoni biogenic amine receptor 0.0072 0.0429 1
Schistosoma mansoni biogenic amine receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Brugia malayi RE15519p 0.0072 0.0429 1
Echinococcus multilocularis neuropeptide receptor 0.0072 0.0429 1
Onchocerca volvulus 0.0072 0.0429 0.5
Echinococcus multilocularis neuropeptides capa receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide receptor 0.0072 0.0429 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0072 0.0429 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0072 0.0429 1
Echinococcus granulosus g protein coupled receptor 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus neuropeptide receptor 0.0072 0.0429 1
Schistosoma mansoni opsin-like receptor 0.0072 0.0429 1
Echinococcus multilocularis fmrfamide receptor 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Brugia malayi sulfakinin receptor protein 0.0072 0.0429 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0072 0.0429 1
Brugia malayi hypothetical protein 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Echinococcus granulosus tm gpcr rhodopsin 0.0072 0.0429 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0072 0.0429 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0429 1
Schistosoma mansoni amine GPCR 0.0072 0.0429 1
Echinococcus multilocularis serotonin receptor 0.0072 0.0429 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0072 0.0429 1
Schistosoma mansoni neuropeptide receptor 0.0072 0.0429 1
Echinococcus multilocularis allatostatin A receptor 0.0072 0.0429 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0028 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 5.8584 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) 44.6684 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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