Detailed information for compound 1321284

Basic information

Technical information
  • TDR Targets ID: 1321284
  • Name: N-[2-[1-[(2-hydroxy-5-methoxyphenyl)methyl]pi peridin-4-yl]pyrazol-3-yl]-3-(phenoxy)propana mide
  • MW: 450.53 | Formula: C25H30N4O4
  • H donors: 2 H acceptors: 3 LogP: 2.95 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(c(c1)CN1CCC(CC1)n1nccc1NC(=O)CCOc1ccccc1)O
  • InChi: 1S/C25H30N4O4/c1-32-22-7-8-23(30)19(17-22)18-28-14-10-20(11-15-28)29-24(9-13-26-29)27-25(31)12-16-33-21-5-3-2-4-6-21/h2-9,13,17,20,30H,10-12,14-16,18H2,1H3,(H,27,31)
  • InChiKey: BJNJSIYQXLOOPE-UHFFFAOYSA-N  

Network

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Synonyms

  • N-[2-[1-[(2-hydroxy-5-methoxy-phenyl)methyl]-4-piperidyl]pyrazol-3-yl]-3-(phenoxy)propanamide
  • N-[2-[1-[(2-hydroxy-5-methoxyphenyl)methyl]-4-piperidinyl]-3-pyrazolyl]-3-(phenoxy)propanamide
  • N-[2-[1-(2-hydroxy-5-methoxy-benzyl)-4-piperidyl]pyrazol-3-yl]-3-(phenoxy)propionamide
  • N-[2-[1-[(2-hydroxy-5-methoxy-phenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-3-(phenoxy)propanamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0047 0.0126 0.0124
Schistosoma mansoni hypothetical protein 0.0015 0.0028 0.0026
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0015 0.0027 0.0026
Echinococcus granulosus geminin 0.0205 0.0608 0.0606
Echinococcus multilocularis orexin receptor type 2 0.0047 0.0126 0.0124
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0047 0.0126 0.0124
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0015 0.0027 0.0026
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0028 0.0026
Schistosoma mansoni steroid hormone receptor ad4bp 0.0015 0.0027 0.0026
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni neuropeptide receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0007 0.0003 0.0001
Brugia malayi Tachykinin-like peptides receptor 99D 0.0047 0.0126 0.0123
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0088 0.0086
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0047 0.0126 0.0124
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0082 0.0079
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.0335 0.0333
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Echinococcus multilocularis g protein coupled receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0005 0.0003
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0007 0.0003 0.0001
Echinococcus multilocularis serotonin receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0047 0.0126 1
Schistosoma mansoni hypothetical protein 0.0033 0.0082 0.008
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0015 0.0027 0.0025
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0015 0.0027 0.0026
Schistosoma mansoni hypothetical protein 0.0047 0.0126 0.0124
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis ecdysone induced protein 78C 0.0015 0.0027 0.0026
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0015 0.0027 0.0026
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0007 0.0003 0.0001
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni biogenic amine receptor 0.0047 0.0126 0.0124
Echinococcus granulosus 7tm_1 domain containing protein 0.0047 0.0126 0.0124
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0027 0.0025
Echinococcus granulosus fmrfamide receptor 0.0047 0.0126 0.0124
Entamoeba histolytica hypothetical protein 0.0035 0.0088 0.5
Echinococcus granulosus G protein coupled receptor 139 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0124 0.9861
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 0.0126 0.0124
Brugia malayi G protein-coupled receptor F59B2.13 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis FTZ F1 alpha 0.0015 0.0027 0.0026
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0008 0.0005 0.0003
Echinococcus granulosus neuropeptides capa receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis protein patched 0.1346 0.4106 0.4104
Loa Loa (eye worm) G-protein coupled receptor 0.0047 0.0126 0.0123
Echinococcus granulosus g protein coupled receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0015 0.0027 0.0025
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.0335 0.0333
Schistosoma mansoni smad1 5 8 and 0.0008 0.0005 0.0003
Echinococcus multilocularis neuropeptide s receptor 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0047 0.0126 0.0124
Brugia malayi G protein-coupled receptor 0.0047 0.0126 0.0123
Schistosoma mansoni neuropeptide receptor 0.0047 0.0126 0.0124
Brugia malayi nuclear hormone receptor 0.0015 0.0027 0.0025
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0015 0.0027 0.0026
Schistosoma mansoni neuropeptide F-like receptor 0.0047 0.0126 0.0124
Brugia malayi hypothetical protein 0.0008 0.0005 0.0003
Echinococcus granulosus Niemann Pick C1 protein 0.1346 0.4106 0.4104
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.327 1 1
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.1534 0.4681 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0162 0.016
Echinococcus multilocularis fmrfamide receptor 0.0047 0.0126 0.0124
Brugia malayi Serotonin receptor 0.0047 0.0126 0.0123
Echinococcus granulosus survival motor neuron protein 1 0.0229 0.0683 0.0681
Echinococcus multilocularis neuropeptide Y receptor 0.0047 0.0126 0.0124
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0015 0.0027 0.2006
Echinococcus multilocularis dro:myosuppressin receptor 0.0047 0.0126 0.0124
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0007 0.0003 0.0001
Loa Loa (eye worm) neuropeptide F receptor 0.0047 0.0126 0.0123
Brugia malayi GnHR receptor homolog 0.0047 0.0126 0.0123
Brugia malayi AKH receptor 0.0047 0.0126 0.0123
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0015 0.0027 0.0026
Brugia malayi ORL1-like opioid receptor 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0015 0.0027 0.2006
Echinococcus granulosus neuropeptides capa receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0015 0.0027 0.0025
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni growth hormone secretagogue receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0015 0.0027 0.0026
Echinococcus granulosus neuropeptide receptor 0.0047 0.0126 0.0124
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0028 0.0066 0.5147
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0015 0.0027 0.0025
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0047 0.0126 0.0124
Echinococcus multilocularis Niemann Pick C1 protein 0.1346 0.4106 0.4104
Echinococcus granulosus smad 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus orexin receptor type 2 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0005 0.0003
Schistosoma mansoni nuclear receptor nhr-48 0.0007 0.0003 0.0001
Echinococcus multilocularis Smad4 0.0008 0.0005 0.0003
Echinococcus multilocularis neuropeptides capa receptor 0.0047 0.0126 0.0124
Echinococcus granulosus g-protein coupled receptor 0.0047 0.0126 0.0124
Echinococcus granulosus tm gpcr rhodopsin 0.0047 0.0126 0.0124
Brugia malayi hypothetical protein 0.0008 0.0005 0.0003
Brugia malayi Smad1 0.0008 0.0005 0.0002
Schistosoma mansoni opsin-like receptor 0.0047 0.0126 0.0124
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Onchocerca volvulus Bile acid receptor homolog 0.0015 0.0027 0.2006
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0047 0.0126 0.0123
Schistosoma mansoni smad1 5 8 and 0.0008 0.0005 0.0003
Echinococcus multilocularis neuropeptide receptor A26 0.0047 0.0126 0.0124
Schistosoma mansoni cpg binding protein 0.0029 0.0071 0.0069
Loa Loa (eye worm) melatonin receptor type 1A 0.0047 0.0126 0.0123
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0047 0.0126 0.0124
Schistosoma mansoni neuropeptide receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0028 0.0025
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus granulosus neuropeptide s receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Schistosoma mansoni hypothetical protein 0.0035 0.0088 0.0086
Echinococcus multilocularis neuropeptide receptor 0.0047 0.0126 0.0124
Brugia malayi nuclear receptor RXR 0.0008 0.0005 0.0003
Brugia malayi MH2 domain containing protein 0.0008 0.0005 0.0002
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0047 0.0126 0.0124
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0088 0.0086
Schistosoma mansoni nuclear receptor 0.0007 0.0003 0.0001
Schistosoma mansoni smad 0.0008 0.0005 0.0003
Echinococcus granulosus neuropeptide receptor A26 0.0047 0.0126 0.0124
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0028 0.0025
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.327 1 0.5
Onchocerca volvulus 0.0047 0.0126 1
Onchocerca volvulus 0.0047 0.0126 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0015 0.0027 0.0025
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.1534 0.4681 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0129 0.0126
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0015 0.0027 0.0026
Brugia malayi Dopamine receptor 0.0047 0.0126 0.0123
Brugia malayi larval opioid receptor 0.0047 0.0126 0.0123
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni neuropeptide receptor 0.0047 0.0126 0.0124
Schistosoma mansoni hypothetical protein 0.0015 0.0028 0.0026
Echinococcus granulosus allatostatin A receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0047 0.0126 0.0123
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0129 0.0126
Brugia malayi photoreceptor-specific nuclear receptor 0.0015 0.0027 0.0025
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0015 0.0027 0.0026
Schistosoma mansoni hypothetical protein 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Schistosoma mansoni histamine h1 receptor 0.0047 0.0126 0.0124
Echinococcus granulosus thyroid hormone receptor alpha 0.0007 0.0003 0.0001
Schistosoma mansoni hypothetical protein 0.0205 0.0608 0.0606
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0066 0.0063
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.1534 0.4681 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 0.0126 0.0124
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0007 0.0004
Echinococcus multilocularis serotonin receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.1346 0.4106 0.4104
Brugia malayi MH1 domain containing protein 0.0008 0.0005 0.0002
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis sex peptide receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0047 0.0126 0.0123
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Schistosoma mansoni opsin-like receptor 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Brugia malayi Steroid receptor seven-up type 2 0.0015 0.0027 0.0025
Brugia malayi G-protein coupled receptor 0.0047 0.0126 0.0123
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis GPCR, family 2 0.0015 0.0028 0.0026
Schistosoma mansoni biogenic amine receptor 0.0047 0.0126 0.0124
Schistosoma mansoni RAR-like nuclear receptor 0.0015 0.0027 0.0026
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0015 0.0027 0.0025
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0047 0.0126 0.0124
Brugia malayi CHE-14 protein 0.1346 0.4106 0.4104
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0028 0.0026
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus ecdysone induced protein 78C 0.0015 0.0027 0.0026
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.1346 0.4106 0.4104
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0015 0.0027 0.0026
Loa Loa (eye worm) hypothetical protein 0.0048 0.0129 0.0126
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0028 0.0026
Brugia malayi ecdysteroid receptor 0.0015 0.0027 0.0025
Echinococcus granulosus g protein coupled receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0047 0.0126 0.0124
Schistosoma mansoni neuropeptide f receptor 76f 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.0047 0.0126 0.0124
Echinococcus granulosus alpha 1A adrenergic receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.327 1 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0008 0.0005 0.0003
Schistosoma mansoni nuclear hormone receptor 0.0007 0.0003 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0015 0.0027 0.0025
Echinococcus granulosus Nuclear hormone receptor HR96 0.0007 0.0003 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0015 0.0027 0.0025
Schistosoma mansoni thyroid hormone receptor 0.0015 0.0027 0.0026
Echinococcus multilocularis sterol regulatory element binding protein 0.1346 0.4106 0.4104
Loa Loa (eye worm) hypothetical protein 0.0033 0.0082 0.0079
Brugia malayi follicle stimulating hormone receptor 0.0047 0.0126 0.0123
Brugia malayi sulfakinin receptor protein 0.0047 0.0126 0.0123
Brugia malayi CXXC zinc finger family protein 0.0028 0.0066 0.0063
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis G protein coupled receptor 139 0.0047 0.0126 0.0124
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.327 1 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0015 0.0027 0.0025
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0015 0.0027 0.0025
Onchocerca volvulus 0.0047 0.0126 1
Schistosoma mansoni amine GPCR 0.0047 0.0126 0.0124
Brugia malayi RE15519p 0.0047 0.0126 0.0123
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0005 0.0002
Entamoeba histolytica hypothetical protein 0.0035 0.0088 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0047 0.0126 0.0124
Schistosoma mansoni biogenic amine (5HT) receptor 0.0047 0.0126 0.0124
Echinococcus granulosus nuclear receptor nhr 48 0.0007 0.0003 0.0001
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0047 0.0126 0.0124
Echinococcus granulosus 7TM GPCR rhodopsin 0.0047 0.0126 0.0124
Brugia malayi steroid hormone receptor 0.0015 0.0027 0.0025
Schistosoma mansoni amine GPCR 0.0047 0.0126 0.0124
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 0.0126 0.0124
Schistosoma mansoni Smad4 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Echinococcus granulosus Nuclear hormone receptor HR96 0.0007 0.0003 0.0001
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0047 0.0126 0.0124
Echinococcus granulosus sterol regulatory element binding protein 0.1346 0.4106 0.4104
Echinococcus multilocularis allatostatin A receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis survival motor neuron protein 1 0.0229 0.0683 0.0681
Echinococcus multilocularis G-protein coupled receptor, putative 0.0047 0.0126 0.0124
Brugia malayi Nuclear hormone receptor-like 1 0.0008 0.0005 0.0003
Schistosoma mansoni zinc finger protein 0.0007 0.0003 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis thyroid hormone receptor alpha 0.0015 0.0027 0.0026
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni hypothetical protein 0.0015 0.0028 0.0026
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 0.0126 0.0124
Brugia malayi MH1 domain containing protein 0.0008 0.0005 0.0002
Echinococcus granulosus Smad4 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Echinococcus granulosus biogenic amine 5HT receptor 0.0047 0.0126 0.0124
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0008 0.0005 0.0003
Brugia malayi G-protein coupled receptor 0.0047 0.0126 0.0123
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0007 0.0003 0.0001
Loa Loa (eye worm) hypothetical protein 0.0229 0.0683 0.0681
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0008 0.0005 0.0003
Echinococcus multilocularis fmrfamide receptor 0.0047 0.0126 0.0124
Schistosoma mansoni nuclear receptor 0.0007 0.0003 0.0001
Schistosoma mansoni hypothetical protein 0.0015 0.0028 0.0026
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.2981 0.2979
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0047 0.0126 0.0123
Echinococcus multilocularis g protein coupled receptor 0.0047 0.0126 0.0124
Entamoeba histolytica hypothetical protein 0.0035 0.0088 0.5
Schistosoma mansoni amine GPCR 0.0047 0.0126 0.0124
Brugia malayi Dopamine receptor protein 1 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0015 0.0027 0.0026
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0015 0.0027 0.0026
Echinococcus multilocularis neuropeptide receptor 0.0047 0.0126 0.0124
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.327 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis smad 0.0008 0.0005 0.0003
Loa Loa (eye worm) steroid hormone receptor 0.0015 0.0027 0.0025
Echinococcus granulosus tm gpcr rhodopsin 0.0047 0.0126 0.0124
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus sex peptide receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0015 0.0027 0.0026
Echinococcus multilocularis dnaJ subfamily B 0.0397 0.1196 0.1194
Schistosoma mansoni hypothetical protein 0.0047 0.0126 0.0124
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0047 0.0126 0.0124
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0047 0.0126 0.0124
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Schistosoma mansoni adenoreceptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi Dopamine receptor protein 2 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus peptide allatostatin:somatostatin 0.0047 0.0126 0.0124
Onchocerca volvulus Protein ultraspiracle homolog 0.0015 0.0027 0.2006
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0124 0.0121
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0015 0.0027 0.0025
Echinococcus multilocularis geminin 0.0205 0.0608 0.0606
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0047 0.0126 0.0124
Brugia malayi hypothetical protein 0.0229 0.0683 0.0681
Echinococcus granulosus neuropeptide Y receptor 0.0047 0.0126 0.0124
Schistosoma mansoni myosin xvIII 0.0047 0.0126 0.0124
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0007 0.0005
Schistosoma mansoni biogenic amine receptor 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Brugia malayi MH2 domain containing protein 0.0008 0.0005 0.0002
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0047 0.0126 0.0123
Brugia malayi Melatonin receptor type 1A 0.0047 0.0126 0.0123
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0005 0.0002
Schistosoma mansoni smad1 5 8 and 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0008 0.0005 0.0003
Schistosoma mansoni survival motor neuron protein 0.0047 0.0124 0.0122
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus granulosus neuropeptide Y receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis cpg binding protein 0.0029 0.0071 0.0069
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.327 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0047 0.0126 0.0124
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis somatostatin receptor 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus granulosus serotonin receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0047 0.0126 0.0124
Schistosoma mansoni niemann-pick C1 (NPC1) 0.1346 0.4106 0.4104
Entamoeba histolytica hypothetical protein 0.0035 0.0088 0.5
Echinococcus multilocularis g protein coupled receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0015 0.0027 0.0025
Brugia malayi hypothetical protein 0.0035 0.0088 0.0085
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus tachykinin peptides receptor 99D 0.0047 0.0126 0.0124
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0047 0.0126 0.0124
Schistosoma mansoni hypothetical protein 0.0397 0.1196 0.1194
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0005 0.0003
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.1534 0.4681 0.5
Echinococcus granulosus Protein patched homolog 1 0.1346 0.4106 0.4104
Onchocerca volvulus Neuropeptide F receptor homolog 0.0047 0.0126 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0008 0.0005 0.0003
Schistosoma mansoni thyroid hormone receptor 0.0015 0.0027 0.0026
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0008 0.0005 0.0003
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0047 0.0126 0.0124
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0047 0.0126 1
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0007 0.0004
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0015 0.0027 0.0025
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus neuropeptide receptor 0.0047 0.0126 0.0124
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0047 0.0126 0.0124
Schistosoma mansoni hypothetical protein 0.0205 0.0608 0.0606
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0015 0.0027 0.0026
Schistosoma mansoni hypothetical protein 0.0047 0.0124 0.0122
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Onchocerca volvulus 0.0047 0.0126 1
Brugia malayi MH2 domain containing protein 0.0116 0.0335 0.0333
Echinococcus granulosus FTZ F1 alpha 0.0015 0.0027 0.0026
Schistosoma mansoni cpg binding protein 0.0029 0.0071 0.0069
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) Smad1 0.0008 0.0005 0.0002
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0007 0.0003 0.0001
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus GPCR family 2 0.0015 0.0028 0.0026
Schistosoma mansoni amine GPCR 0.0047 0.0126 0.0124
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0007 0.0003 0.0001
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0047 0.0126 0.0123
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0015 0.0027 0.0026
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus granulosus hypothetical protein 0.0047 0.0126 0.0124
Loa Loa (eye worm) TYRA-2 protein 0.0047 0.0126 0.0123
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0005 0.0003
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0047 0.0126 0.0124
Schistosoma mansoni nuclear hormone receptor 0.0015 0.0027 0.0026
Schistosoma mansoni nuclear hormone receptor 0.0007 0.0003 0.0001
Echinococcus granulosus cpg binding protein 0.0029 0.0071 0.0069
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0015 0.0027 0.0026
Schistosoma mansoni cpg binding protein 0.0028 0.0066 0.0064
Echinococcus multilocularis neuropeptide Y receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0015 0.0027 0.0025
Echinococcus granulosus dnaJ subfamily B 0.0397 0.1196 0.1194
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 0.0126 0.0124
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.327 1 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0047 0.0126 0.0124
Echinococcus granulosus g protein coupled receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0015 0.0027 0.0025
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0088 0.0086
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.0015 0.0028 0.0025
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0047 0.0126 0.0124
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0142 0.5
Brugia malayi nuclear receptor NHR-88 0.0015 0.0027 0.0025
Loa Loa (eye worm) neuropeptide F receptor 0.0047 0.0126 0.0123
Brugia malayi putative neuropeptide receptor NPR1 0.0047 0.0126 0.0123
Echinococcus granulosus neuropeptide FF receptor 2 0.0047 0.0126 0.0124
Echinococcus multilocularis neuropeptides capa receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) G-protein coupled receptor 0.0047 0.0126 0.0123
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.327 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0047 0.0126 0.0124
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0015 0.0027 0.0025
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0047 0.0126 0.0124
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0007 0.0005
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0015 0.0027 0.0026
Onchocerca volvulus 0.0047 0.0126 1
Echinococcus granulosus somatostatin receptor 0.0047 0.0126 0.0124
Schistosoma mansoni coup transcription factor 0.0015 0.0027 0.0026
Brugia malayi neuropeptide F receptor 0.0047 0.0126 0.0123
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0015 0.0027 0.0026
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis g-protein coupled receptor 0.0047 0.0126 0.0124
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0129 0.0126
Schistosoma mansoni amine GPCR 0.0047 0.0126 0.0124
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0007 0.0003 0.0001
Echinococcus granulosus biogenic amine 5HT receptor 0.0047 0.0126 0.0124
Schistosoma mansoni opsin-like receptor 0.0047 0.0126 0.0124
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0028 0.0026
Brugia malayi neuropeptide F receptor 0.0047 0.0126 0.0123
Schistosoma mansoni patched 1 0.1346 0.4106 0.4104
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0015 0.0027 0.0025
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0015 0.0027 0.0025
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0047 0.0126 0.0123
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0015 0.0027 0.0025
Loa Loa (eye worm) hypothetical protein 0.0008 0.0005 0.0003
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0015 0.0027 0.0026
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0047 0.0126 0.0124
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 0.0126 0.0124
Echinococcus granulosus dro:myosuppressin receptor 0.0047 0.0126 0.0124
Trichomonas vaginalis conserved hypothetical protein 0.1346 0.4106 0.877
Echinococcus multilocularis nuclear receptor nhr 48 0.0007 0.0003 0.0001
Echinococcus multilocularis neuropeptide FF receptor 2 0.0047 0.0126 0.0124
Onchocerca volvulus 0.0047 0.0126 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0015 0.0027 0.0025
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0028 0.0025
Brugia malayi Serotonin receptor 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0047 0.0126 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Brugia malayi putative neuropeptide receptor 0.0047 0.0126 0.0123
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0015 0.0027 0.0025
Schistosoma mansoni hypothetical protein 0.0047 0.0126 0.0124
Echinococcus multilocularis protein dispatched 1 0.1346 0.4106 0.4104
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0005 0.0003
Loa Loa (eye worm) hypothetical protein 0.327 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0015 0.0027 0.0026
Brugia malayi hypothetical protein 0.0047 0.0126 0.0123
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0123
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0007 0.0003 0.0001

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 150 um PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Identify Inhibitors of Streptokinase Promotor Activity. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1662 (Primary HTS)] ChEMBL. No reference
EC50 (functional) > 150 um PUBCHEM_BIOASSAY: Absorbance Microorganism-Based Dose Response HTS to Identify Inhibitors of Streptokinase Expression. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1902 (Retest at Dose), 1900 (Counter Screen), 1662 (Primary HTS)] ChEMBL. No reference
Potency (functional) 3.9811 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 9.285 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) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 18.3489 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) 18.3564 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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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