Detailed information for compound 1406809

Basic information

Technical information
  • TDR Targets ID: 1406809
  • Name: (2-methylsulfanylphenyl)-[1-(thiadiazole-4-ca rbonyl)piperidin-3-yl]methanone
  • MW: 347.455 | Formula: C16H17N3O2S2
  • H donors: 0 H acceptors: 4 LogP: 2.58 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccccc1C(=O)C1CCCN(C1)C(=O)c1csnn1
  • InChi: 1S/C16H17N3O2S2/c1-22-14-7-3-2-6-12(14)15(20)11-5-4-8-19(9-11)16(21)13-10-23-18-17-13/h2-3,6-7,10-11H,4-5,8-9H2,1H3
  • InChiKey: AKURUKNQDJYGJR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2-methylsulfanylphenyl)-[1-(thiadiazole-4-carbonyl)-3-piperidyl]methanone
  • [2-(methylthio)phenyl]-[1-[oxo-(4-thiadiazolyl)methyl]-3-piperidinyl]methanone
  • [2-(methylthio)phenyl]-[1-(thiadiazole-4-carbonyl)-3-piperidyl]methanone
  • (2-methylsulfanylphenyl)-[1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidin-3-yl]methanone
  • [2-(methylthio)phenyl][1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidin-3-yl]methanone
  • MLS000734420
  • SMR000319437

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
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 neuropeptide FF receptor 2 0.0154 0.0651 0.0651
Schistosoma mansoni lamin 0.0027 0.0038 0.0123
Trypanosoma brucei cytochrome P450, putative 0.0025 0.0027 0.4027
Entamoeba histolytica hypothetical protein 0.0077 0.0277 1
Schistosoma mansoni amine GPCR 0.0154 0.0651 0.2142
Echinococcus multilocularis musashi 0.0027 0.0038 0.0038
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0984 0.4668 1
Schistosoma mansoni bromodomain containing protein 0.0076 0.0275 0.0905
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus granulosus zinc finger protein 0.0024 0.0019 0.0019
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0005 0.0015
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.0603 0.1985
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus granulosus g protein coupled receptor 0.0154 0.0651 0.0651
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Schistosoma mansoni myosin xvIII 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) CYP4Cod1 0.0025 0.0027 0.0153
Echinococcus multilocularis muscleblind protein 1 0.0152 0.064 0.064
Schistosoma mansoni cellular tumor antigen P53 0.0054 0.0168 0.0553
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus granulosus G protein coupled receptor 139 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus multilocularis fmrfamide receptor 0.0154 0.0651 0.0651
Brugia malayi G protein-coupled receptor F59B2.13 0.0154 0.0651 0.2142
Echinococcus multilocularis g protein coupled receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.0603 0.0603
Brugia malayi GnHR receptor homolog 0.0154 0.0651 0.2142
Entamoeba histolytica hypothetical protein 0.0077 0.0277 1
Echinococcus granulosus intermediate filament protein 0.0027 0.0038 0.0038
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0021 0.0005 0.0015
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis G protein coupled receptor 139 0.0154 0.0651 0.0651
Schistosoma mansoni biogenic amine (5HT) receptor 0.0154 0.0651 0.2142
Schistosoma mansoni hypothetical protein 0.0154 0.0651 0.2142
Mycobacterium leprae Conserved hypothetical protein 0.0647 0.3038 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus granulosus sodium:glucose cotransporter 0.0042 0.0109 0.0109
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0077 0.0277 0.0277
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Onchocerca volvulus 0.0154 0.0651 0.1324
Onchocerca volvulus 0.0154 0.0651 0.1324
Entamoeba histolytica hypothetical protein 0.0077 0.0277 1
Echinococcus granulosus muscleblind protein 0.0152 0.064 0.064
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0154 0.0651 0.0651
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus multilocularis allatostatin A receptor 0.0154 0.0651 0.0651
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Schistosoma mansoni hypothetical protein 0.0035 0.0072 0.0239
Schistosoma mansoni alpha-1 adrenergic receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis neuropeptide receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0115 0.0115
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0154 0.0651 0.2142
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus granulosus fmrfamide receptor 0.0154 0.0651 0.0651
Schistosoma mansoni neuropeptide receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0008 0.0046
Echinococcus granulosus neuropeptide Y receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0154 0.0651 0.3707
Brugia malayi putative neuropeptide receptor 0.0154 0.0651 0.2142
Schistosoma mansoni hypothetical protein 0.0647 0.3038 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0072 0.0239
Echinococcus granulosus g protein coupled receptor 0.0154 0.0651 0.0651
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0033 0.0067 1
Onchocerca volvulus 0.0042 0.0109 0.0154
Echinococcus multilocularis sex peptide receptor 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis neuropeptide Y receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0067 0.0067
Echinococcus multilocularis Transglutaminase 0.0647 0.3038 0.3038
Echinococcus granulosus neuropeptide Y receptor 0.0154 0.0651 0.0651
Brugia malayi RE15519p 0.0154 0.0651 0.2142
Brugia malayi intermediate filament protein 0.0027 0.0038 0.0123
Echinococcus granulosus tachykinin peptides receptor 99D 0.0154 0.0651 0.0651
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0154 0.0651 0.0651
Schistosoma mansoni growth hormone secretagogue receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) cytochrome P450 family protein 0.0025 0.0027 0.0153
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0077 0.0277 0.0277
Loa Loa (eye worm) neuropeptide F receptor 0.0154 0.0651 0.3707
Echinococcus multilocularis g protein coupled receptor 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0154 0.0651 0.0651
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0033 0.0067 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0072 0.0413
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.0603 0.0603
Schistosoma mansoni neuropeptide f receptor 76f 0.0154 0.0651 0.2142
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus granulosus peptide allatostatin:somatostatin 0.0154 0.0651 0.0651
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0025 0.0145
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) RNA binding protein 0.007 0.0242 0.1379
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0154 0.0651 0.1324
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0038 0.0123
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0085 0.0318 0.1814
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Schistosoma mansoni tar DNA-binding protein 0.007 0.0242 0.0797
Schistosoma mansoni inositol transporter 0.0042 0.0109 0.0359
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus granulosus neuropeptide receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0021 0.0005 0.0005
Brugia malayi Melatonin receptor type 1A 0.0154 0.0651 0.2142
Brugia malayi follicle stimulating hormone receptor 0.0154 0.0651 0.2142
Schistosoma mansoni tar DNA-binding protein 0.007 0.0242 0.0797
Echinococcus granulosus 7TM GPCR rhodopsin 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi RNA binding protein 0.007 0.0242 0.0797
Mycobacterium tuberculosis Conserved protein 0.0647 0.3038 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Onchocerca volvulus 0.0154 0.0651 0.1324
Schistosoma mansoni neuropeptide receptor 0.0154 0.0651 0.2142
Echinococcus granulosus biogenic amine 5HT receptor 0.0154 0.0651 0.0651
Schistosoma mansoni amine GPCR 0.0154 0.0651 0.2142
Brugia malayi Cytochrome P450 family protein 0.0025 0.0027 0.0088
Echinococcus multilocularis neuropeptide FF receptor 2 0.0154 0.0651 0.0651
Loa Loa (eye worm) TYRA-2 protein 0.0154 0.0651 0.3707
Echinococcus granulosus alpha 1A adrenergic receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) cytochrome P450 family protein 0.0058 0.0183 0.1045
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.0603 0.0603
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0154 0.0651 0.3707
Brugia malayi G-protein coupled receptor 0.0154 0.0651 0.2142
Echinococcus granulosus biogenic amine 5HT receptor 0.0154 0.0651 0.0651
Brugia malayi Tachykinin-like peptides receptor 99D 0.0154 0.0651 0.2142
Brugia malayi Dopamine receptor protein 2 0.0154 0.0651 0.2142
Schistosoma mansoni transcription factor LCR-F1 0.0077 0.0277 0.0912
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0038 0.0214
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.0603 0.0603
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0021 0.0005 0.0015
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus multilocularis neuropeptide receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis tar DNA binding protein 0.007 0.0242 0.0242
Brugia malayi PHD-finger family protein 0.003 0.005 0.0166
Echinococcus granulosus sex peptide receptor 0.0154 0.0651 0.0651
Schistosoma mansoni hypothetical protein 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Schistosoma mansoni hypothetical protein 0.0154 0.0651 0.2142
Brugia malayi Serotonin receptor 0.0154 0.0651 0.2142
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0067 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis g-protein coupled receptor 0.0154 0.0651 0.0651
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0154 0.0651 0.0651
Brugia malayi G protein-coupled receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus granulosus neuropeptides capa receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Trypanosoma cruzi cytochrome P450, putative 0.0025 0.0027 0.4027
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0154 0.0651 0.0651
Leishmania major cytochrome p450-like protein 0.0025 0.0027 0.4027
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0254 0.0254
Onchocerca volvulus 0.0154 0.0651 0.1324
Loa Loa (eye worm) hypothetical protein 0.0042 0.0109 0.0621
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0154 0.0651 0.1324
Echinococcus granulosus lamin 0.0027 0.0038 0.0038
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.0603 0.1985
Schistosoma mansoni biogenic amine receptor 0.0154 0.0651 0.2142
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0033 0.0067 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0021 0.0005 0.0005
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0067 0.0067
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0067 0.0067
Loa Loa (eye worm) G-protein coupled receptor 0.0154 0.0651 0.3707
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0154 0.0651 0.2142
Loa Loa (eye worm) G-protein coupled receptor 0.0154 0.0651 0.3707
Brugia malayi larval opioid receptor 0.0154 0.0651 0.2142
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0037 0.0121
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0033 0.0067 0.0219
Echinococcus multilocularis zinc finger protein 0.0024 0.0019 0.0019
Echinococcus granulosus tumor protein p63 0.0371 0.1703 0.1703
Loa Loa (eye worm) hypothetical protein 0.0152 0.064 0.3645
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Mycobacterium ulcerans putative transglutaminase-like protein 0.0647 0.3038 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Onchocerca volvulus 0.0154 0.0651 0.1324
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0033 0.0067 0.0219
Schistosoma mansoni zinc finger protein 0.0024 0.0019 0.0064
Echinococcus granulosus sodium:myo inositol cotransporter 0.0042 0.0109 0.0109
Schistosoma mansoni neuropeptide F-like receptor 0.0154 0.0651 0.2142
Brugia malayi Muscleblind-like protein 0.0152 0.064 0.2106
Schistosoma mansoni opsin-like receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis geminin 0.0348 0.1589 0.1589
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi neuropeptide F receptor 0.0154 0.0651 0.2142
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0067 1
Toxoplasma gondii isocitrate dehydrogenase 0.0033 0.0067 0.6121
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis tumor protein p63 0.0371 0.1703 0.1703
Schistosoma mansoni adenoreceptor 0.0154 0.0651 0.2142
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0154 0.0651 0.0651
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.015 0.0494
Echinococcus multilocularis G-protein coupled receptor, putative 0.0154 0.0651 0.0651
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0115 0.0115
Echinococcus granulosus histone lysine methyltransferase setb 0.0021 0.0005 0.0005
Echinococcus granulosus rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0033 0.0067 0.0067
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Loa Loa (eye worm) neuropeptide F receptor 0.0154 0.0651 0.3707
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0154 0.0651 0.0651
Echinococcus granulosus serotonin receptor 0.0154 0.0651 0.0651
Schistosoma mansoni neuropeptide receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0051 0.015 0.0855
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Giardia lamblia Hypothetical protein 0.0647 0.3038 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Onchocerca volvulus 0.0154 0.0651 0.1324
Schistosoma mansoni biogenic amine (5HT) receptor 0.0154 0.0651 0.2142
Schistosoma mansoni opsin-like receptor 0.0154 0.0651 0.2142
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0154 0.0651 0.2142
Echinococcus granulosus geminin 0.0348 0.1589 0.1589
Giardia lamblia Transglutaminase/protease, putative 0.0647 0.3038 1
Brugia malayi sulfakinin receptor protein 0.0154 0.0651 0.2142
Brugia malayi hypothetical protein 0.0077 0.0277 0.0912
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0038 0.0214
Mycobacterium leprae Conserved hypothetical protein 0.0647 0.3038 0.5
Echinococcus multilocularis somatostatin receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Schistosoma mansoni neuropeptide receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0049 0.0143 0.0815
Loa Loa (eye worm) isocitrate dehydrogenase 0.0033 0.0067 0.038
Echinococcus multilocularis lamin 0.0027 0.0038 0.0038
Echinococcus granulosus sodium:glucose cotransporter 2 0.0042 0.0109 0.0109
Echinococcus multilocularis muscleblind protein 0.0152 0.064 0.064
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0154 0.0651 0.2142
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0154 0.0651 0.2142
Echinococcus granulosus somatostatin receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Schistosoma mansoni amine GPCR 0.0154 0.0651 0.2142
Brugia malayi GH02984p 0.0382 0.1755 0.5777
Echinococcus granulosus dro:myosuppressin receptor 0.0154 0.0651 0.0651
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0067 1
Brugia malayi Serotonin receptor 0.0154 0.0651 0.2142
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus granulosus neuropeptide receptor 0.0154 0.0651 0.0651
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0154 0.0651 0.2142
Onchocerca volvulus Neuropeptide F receptor homolog 0.0154 0.0651 0.1324
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0042 0.0109 0.0109
Trichomonas vaginalis peptide N-glycanase, putative 0.0647 0.3038 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0382 0.1755 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0154 0.0651 0.2142
Schistosoma mansoni hypothetical protein 0.0348 0.1589 0.5232
Mycobacterium ulcerans transglutaminase family protein 0.0647 0.3038 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.007 0.0242 0.1379
Entamoeba histolytica hypothetical protein 0.0077 0.0277 1
Brugia malayi Dopamine receptor 0.0154 0.0651 0.2142
Schistosoma mansoni tar DNA-binding protein 0.007 0.0242 0.0797
Loa Loa (eye worm) cytochrome P450 family protein 0.0025 0.0027 0.0153
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0042 0.0109 0.0109
Echinococcus multilocularis solute carrier family 5 0.0042 0.0109 0.0109
Loa Loa (eye worm) hypothetical protein 0.0052 0.0154 0.0879
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.0603 0.1985
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.015 0.0855
Echinococcus granulosus tm gpcr rhodopsin 0.0154 0.0651 0.0651
Echinococcus granulosus tar DNA binding protein 0.007 0.0242 0.0242
Mycobacterium tuberculosis Hypothetical protein 0.0647 0.3038 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0154 0.0651 0.2142
Brugia malayi Cytochrome P450 family protein 0.0025 0.0027 0.0088
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus multilocularis neuropeptides capa receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Schistosoma mansoni amine GPCR 0.0154 0.0651 0.2142
Echinococcus multilocularis dro:myosuppressin receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0021 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi Thioredoxin family protein 0.0647 0.3038 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0154 0.0651 0.2142
Brugia malayi TAR-binding protein 0.007 0.0242 0.0797
Echinococcus multilocularis g protein coupled receptor 0.0154 0.0651 0.0651
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0033 0.0067 0.0067
Schistosoma mansoni intermediate filament proteins 0.0027 0.0038 0.0123
Echinococcus granulosus tm gpcr rhodopsin 0.0154 0.0651 0.0651
Brugia malayi Sodium:solute symporter family protein 0.0042 0.0109 0.0359
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0042 0.0109 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0824 0.3894 0.3894
Echinococcus granulosus tm gpcr rhodopsin 0.0154 0.0651 0.0651
Echinococcus granulosus g protein coupled receptor 0.0154 0.0651 0.0651
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0154 0.0651 0.2142
Brugia malayi Isocitrate dehydrogenase 0.0033 0.0067 0.0219
Brugia malayi RNA recognition motif domain containing protein 0.007 0.0242 0.0797
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0152 0.064 0.3645
Echinococcus multilocularis orexin receptor type 2 0.0154 0.0651 0.0651
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0154 0.0651 0.0651
Mycobacterium ulcerans hypothetical protein 0.0647 0.3038 1
Schistosoma mansoni hypothetical protein 0.0154 0.0651 0.2142
Schistosoma mansoni hypothetical protein 0.0077 0.0277 0.0912
Loa Loa (eye worm) hypothetical protein 0.0021 0.0005 0.0026
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0154 0.0651 0.2142
Echinococcus granulosus g-protein coupled receptor 0.0154 0.0651 0.0651
Brugia malayi Bromodomain containing protein 0.0091 0.0343 0.113
Schistosoma mansoni hypothetical protein 0.0348 0.1589 0.5232
Onchocerca volvulus 0.0054 0.0168 0.0282
Trypanosoma cruzi cytochrome P450, putative 0.0025 0.0027 0.4027
Echinococcus granulosus hypothetical protein 0.0154 0.0651 0.0651
Echinococcus granulosus orexin receptor type 2 0.0154 0.0651 0.0651
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0037 0.0037
Echinococcus multilocularis high affinity choline transporter 1 0.0382 0.1755 0.1755
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0054 0.0168 0.0958
Brugia malayi Dopamine receptor protein 1 0.0154 0.0651 0.2142
Onchocerca volvulus 0.0154 0.0651 0.1324
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus granulosus 7tm_1 domain containing protein 0.0154 0.0651 0.0651
Schistosoma mansoni tar DNA-binding protein 0.007 0.0242 0.0797
Mycobacterium ulcerans hypothetical protein 0.0647 0.3038 1
Brugia malayi Bromodomain containing protein 0.0046 0.0129 0.0424
Schistosoma mansoni neuropeptide F-like receptor 0.0154 0.0651 0.2142
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0033 0.0067 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Schistosoma mansoni sodium/solute symporter 0.0042 0.0109 0.0359
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0005 0.0015
Brugia malayi Cytochrome P450 family protein 0.0058 0.0183 0.0603
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0254 0.0254
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0144 0.0603 0.1985
Schistosoma mansoni amine GPCR 0.0154 0.0651 0.2142
Brugia malayi putative neuropeptide receptor NPR1 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0027 0.0038 0.0214
Echinococcus granulosus lamin dm0 0.0027 0.0038 0.0038
Mycobacterium tuberculosis Long conserved protein 0.0647 0.3038 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0154 0.0651 0.2142
Schistosoma mansoni biogenic amine receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis rhodopsin orphan GPCR 0.0154 0.0651 0.0651
Brugia malayi isocitrate dehydrogenase 0.0033 0.0067 0.0219
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0154 0.0651 0.2142
Schistosoma mansoni lamin 0.0027 0.0038 0.0123
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0144 0.0603 0.3436
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0154 0.0651 0.0651
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0025 0.0027 0.0088
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Echinococcus multilocularis neuropeptide Y receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis serotonin receptor 0.0154 0.0651 0.0651
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0154 0.0651 0.3707
Echinococcus multilocularis isocitrate dehydrogenase 0.0033 0.0067 0.0067
Schistosoma mansoni opsin-like receptor 0.0154 0.0651 0.2142
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus granulosus Transglutaminase 0.0647 0.3038 0.3038
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Mycobacterium tuberculosis Conserved hypothetical protein 0.0647 0.3038 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0154 0.0651 0.3707
Schistosoma mansoni histamine h1 receptor 0.0154 0.0651 0.2142
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0154 0.0651 0.0651
Mycobacterium tuberculosis Conserved hypothetical protein 0.0647 0.3038 1
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Echinococcus granulosus high affinity choline transporter 1 0.0382 0.1755 0.1755
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0154 0.0651 0.2142
Onchocerca volvulus 0.0154 0.0651 0.1324
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0154 0.0651 0.0651
Loa Loa (eye worm) hypothetical protein 0.0027 0.0035 0.02
Echinococcus multilocularis lamin dm0 0.0027 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) melatonin receptor type 1A 0.0154 0.0651 0.3707
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0154 0.0651 0.0651
Onchocerca volvulus 0.0154 0.0651 0.1324
Loa Loa (eye worm) hypothetical protein 0.0046 0.0129 0.0736
Brugia malayi neuropeptide F receptor 0.0154 0.0651 0.2142
Brugia malayi ORL1-like opioid receptor 0.0154 0.0651 0.2142
Schistosoma mansoni inositol transporter 0.0042 0.0109 0.0359
Brugia malayi AKH receptor 0.0154 0.0651 0.2142
Toxoplasma gondii isocitrate dehydrogenase 0.0033 0.0067 0.6121
Loa Loa (eye worm) TAR-binding protein 0.007 0.0242 0.1379
Schistosoma mansoni hypothetical protein 0.0025 0.0025 0.0084
Schistosoma mansoni biogenic amine receptor 0.0154 0.0651 0.2142
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0042 0.0109 0.0109
Echinococcus granulosus neuropeptides capa receptor 0.0154 0.0651 0.0651
Echinococcus granulosus allatostatin A receptor 0.0154 0.0651 0.0651
Schistosoma mansoni high-affinity choline transporter 0.0382 0.1755 0.5777
Echinococcus granulosus solute carrier family 5 0.0042 0.0109 0.0109
Echinococcus multilocularis serotonin receptor 0.0154 0.0651 0.0651
Brugia malayi hypothetical protein 0.0154 0.0651 0.2142
Schistosoma mansoni tar DNA-binding protein 0.007 0.0242 0.0797
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0042 0.0109 0.0109
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0154 0.0651 0.2142
Echinococcus multilocularis neuropeptides capa receptor 0.0154 0.0651 0.0651
Echinococcus multilocularis fmrfamide receptor 0.0154 0.0651 0.0651
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0154 0.0651 0.2142
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Loa Loa (eye worm) hypothetical protein 0.0154 0.0651 0.3707
Brugia malayi G-protein coupled receptor 0.0154 0.0651 0.2142
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.015 0.0494
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0154 0.0651 0.0651

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.13 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) 0.7079 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 23.9341 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] 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

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.