Detailed information for compound 1311012

Basic information

Technical information
  • TDR Targets ID: 1311012
  • Name: N-[(5E)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3 -thiazol-2-yl]benzenesulfonamide
  • MW: 345.396 | Formula: C15H11N3O3S2
  • H donors: 1 H acceptors: 4 LogP: 2.33 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1N=C(S/C/1=C/c1cccnc1)NS(=O)(=O)c1ccccc1
  • InChi: 1S/C15H11N3O3S2/c19-14-13(9-11-5-4-8-16-10-11)22-15(17-14)18-23(20,21)12-6-2-1-3-7-12/h1-10H,(H,17,18,19)/b13-9+
  • InChiKey: RSYDPBQSNWRHDG-UKTHLTGXSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazol-2-yl]benzenesulfonamide
  • N-[(5E)-4-oxo-5-(3-pyridylmethylene)thiazol-2-yl]benzenesulfonamide
  • N-[4-oxo-5-(3-pyridylmethylene)thiazol-2-yl]benzenesulfonamide
  • N-[4-oxo-5-(3-pyridylmethylene)-2-thiazolyl]benzenesulfonamide
  • N-[(5E)-4-oxo-5-(3-pyridylmethylene)-2-thiazolyl]benzenesulfonamide
  • N-[4-keto-5-(3-pyridylmethylene)thiazol-2-yl]benzenesulfonamide
  • N-[(5E)-4-keto-5-(3-pyridylmethylene)thiazol-2-yl]benzenesulfonamide
  • CBMicro_008863
  • A2079/0087416
  • MLS000586690
  • N-[(2E,5E)-4-oxo-5-(pyridin-3-ylmethylene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide
  • SMR000208069
  • ZINC04498736

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens isocitrate dehydrogenase 1 (NADP+), soluble Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium berghei isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium knowlesi isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania donovani isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum hypothetical protein Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi Isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania mexicana isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Babesia bovis isocitrate dehydrogenase, NADP-dependent family protein Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans C terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum Isocitrate dehydrogenase-like protein, related Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania braziliensis isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans N terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Theileria parva isocitrate dehydrogenase (NADP+), putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania infantum isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
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
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0031 1 1
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.1078 0.1078
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Echinococcus granulosus allatostatin A receptor 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Echinococcus multilocularis fmrfamide receptor 0.0031 1 1
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.1078 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0031 1 1
Brugia malayi putative neuropeptide receptor 0.0031 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Brugia malayi putative neuropeptide receptor NPR1 0.0031 1 1
Schistosoma mansoni hypothetical protein 0.0031 1 1
Echinococcus multilocularis G protein coupled receptor 139 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0031 1 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0031 1 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.0031 1 1
Brugia malayi Dopamine receptor 0.0031 1 1
Schistosoma mansoni hypothetical protein 0.0031 1 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0031 1 1
Echinococcus granulosus dna polymerase kappa 0.0023 0.435 0.435
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Brugia malayi isocitrate dehydrogenase 0.0019 0.1078 0.1078
Echinococcus granulosus neuropeptide Y receptor 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Trypanosoma brucei unspecified product 0.0023 0.435 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Schistosoma mansoni neuropeptide receptor 0.0031 1 1
Giardia lamblia DINP protein human, muc B family 0.0023 0.435 0.5
Brugia malayi Serotonin receptor 0.0031 1 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0031 1 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0031 1 1
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.435 0.435
Leishmania major DNA polymerase kappa, putative 0.0023 0.435 1
Schistosoma mansoni myosin xvIII 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.435 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0031 1 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Brugia malayi Melatonin receptor type 1A 0.0031 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi sulfakinin receptor protein 0.0031 1 1
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.1078 0.1078
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Brugia malayi follicle stimulating hormone receptor 0.0031 1 1
Brugia malayi G-protein coupled receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.435 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Schistosoma mansoni neuropeptide F-like receptor 0.0031 1 1
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.1078 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0031 1 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0031 1 1
Schistosoma mansoni hypothetical protein 0.0031 1 1
Loa Loa (eye worm) TYRA-2 protein 0.0031 1 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.0031 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Echinococcus granulosus orexin receptor type 2 0.0031 1 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis dna polymerase eta 0.0023 0.435 0.435
Echinococcus multilocularis neuropeptide Y receptor 0.0031 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0031 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.435 0.435
Echinococcus multilocularis neuropeptides capa receptor 0.0031 1 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Echinococcus granulosus g-protein coupled receptor 0.0031 1 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0031 1 1
Schistosoma mansoni amine GPCR 0.0031 1 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0019 0.1078 0.2479
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.435 0.435
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.435 0.435
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0031 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Schistosoma mansoni amine GPCR 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.1078 0.1078
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus granulosus neuropeptide FF receptor 2 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0031 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Echinococcus granulosus neuropeptide receptor 0.0031 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0031 1 1
Echinococcus granulosus g protein coupled receptor 0.0031 1 1
Echinococcus granulosus hypothetical protein 0.0031 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.435 0.435
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0019 0.1078 1
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.435 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Echinococcus multilocularis g protein coupled receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi neuropeptide F receptor 0.0031 1 1
Echinococcus granulosus fmrfamide receptor 0.0031 1 1
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.435 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0031 1 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.1078 0.1078
Echinococcus granulosus neuropeptide receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni amine GPCR 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.1078 0.1078
Echinococcus multilocularis orexin receptor type 2 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0031 1 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0031 1 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus g protein coupled receptor 0.0031 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0031 1 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Echinococcus multilocularis allatostatin A receptor 0.0031 1 1
Schistosoma mansoni biogenic amine receptor 0.0031 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.0031 1 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni neuropeptide receptor 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0019 0.1078 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus multilocularis g protein coupled receptor 0.0031 1 1
Schistosoma mansoni neuropeptide receptor 0.0031 1 1
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.435 0.5
Echinococcus granulosus neuropeptides capa receptor 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.435 0.435
Onchocerca volvulus 0.0031 1 1
Echinococcus multilocularis fmrfamide receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis neuropeptide s receptor 0.0031 1 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.435 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi Dopamine receptor protein 1 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.435 0.435
Echinococcus granulosus tm gpcr rhodopsin 0.0031 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0031 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0031 1 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.1078 0.1078
Schistosoma mansoni alpha-1 adrenergic receptor 0.0031 1 1
Echinococcus multilocularis serotonin receptor 0.0031 1 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.1078 0.2479
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.435 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0031 1 1
Brugia malayi RE15519p 0.0031 1 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.435 1
Onchocerca volvulus 0.0031 1 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Echinococcus granulosus G protein coupled receptor 139 0.0031 1 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0031 1 1
Schistosoma mansoni amine GPCR 0.0031 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.0031 1 1
Brugia malayi G-protein coupled receptor 0.0031 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.0031 1 1
Echinococcus multilocularis dna polymerase kappa 0.0023 0.435 0.435
Brugia malayi hypothetical protein 0.0031 1 1
Brugia malayi G protein-coupled receptor 0.0031 1 1
Leishmania major DNA polymerase eta, putative 0.0023 0.435 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0031 1 1
Echinococcus multilocularis sex peptide receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Brugia malayi Isocitrate dehydrogenase 0.0019 0.1078 0.1078
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Echinococcus multilocularis g protein coupled receptor 0.0031 1 1
Schistosoma mansoni opsin-like receptor 0.0031 1 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0031 1 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.435 1
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.435 1
Schistosoma mansoni growth hormone secretagogue receptor 0.0031 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0031 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.435 0.5
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.1078 0.1078
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.1078 0.2479
Brugia malayi ORL1-like opioid receptor 0.0031 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.0031 1 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus serotonin receptor 0.0031 1 1
Brugia malayi larval opioid receptor 0.0031 1 1
Echinococcus granulosus dro:myosuppressin receptor 0.0031 1 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Brugia malayi GnHR receptor homolog 0.0031 1 1
Echinococcus multilocularis neuropeptide receptor A26 0.0031 1 1
Brugia malayi AKH receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni opsin-like receptor 0.0031 1 1
Echinococcus multilocularis g-protein coupled receptor 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Schistosoma mansoni amine GPCR 0.0031 1 1
Brugia malayi Dopamine receptor protein 2 0.0031 1 1
Echinococcus granulosus g protein coupled receptor 0.0031 1 1
Schistosoma mansoni adenoreceptor 0.0031 1 1
Echinococcus multilocularis neuropeptide receptor 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Schistosoma mansoni DNA polymerase eta 0.0023 0.435 0.435
Echinococcus granulosus neuropeptide s receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus dna polymerase eta 0.0023 0.435 0.435
Schistosoma mansoni biogenic amine receptor 0.0031 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.435 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Schistosoma mansoni hypothetical protein 0.0031 1 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0031 1 1
Echinococcus multilocularis somatostatin receptor 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.435 0.435
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.435 0.5
Echinococcus granulosus neuropeptide Y receptor 0.0031 1 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0031 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0031 1 1
Echinococcus multilocularis serotonin receptor 0.0031 1 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.1078 0.1078
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.435 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.435 1
Onchocerca volvulus 0.0031 1 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0031 1 1
Echinococcus granulosus neuropeptides capa receptor 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus sex peptide receptor 0.0031 1 1
Brugia malayi hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0031 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0031 1 1
Brugia malayi Serotonin receptor 0.0031 1 1
Schistosoma mansoni histamine h1 receptor 0.0031 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0031 1 1
Echinococcus granulosus somatostatin receptor 0.0031 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0031 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Echinococcus granulosus 7tm_1 domain containing protein 0.0031 1 1
Schistosoma mansoni biogenic amine receptor 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus multilocularis neuropeptide receptor 0.0031 1 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0031 1 1
Schistosoma mansoni opsin-like receptor 0.0031 1 1
Onchocerca volvulus 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Brugia malayi neuropeptide F receptor 0.0031 1 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0031 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0031 1 1
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.435 0.5
Schistosoma mansoni neuropeptide receptor 0.0031 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.435 1
Echinococcus granulosus neuropeptide receptor A26 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 14.1254 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 16.5113 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) 18.3564 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference
Potency (functional) 89.1251 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

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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