Detailed information for compound 1188427

Basic information

Technical information
  • TDR Targets ID: 1188427
  • Name: (2S)-2-[[1-[(2S)-2-[(2-methylpropan-2-yl)oxyc arbonylamino]-4-methylsulfanylbutanoyl]piperi dine-4-carbonyl]amino]propanoic acid
  • MW: 431.547 | Formula: C19H33N3O6S
  • H donors: 3 H acceptors: 5 LogP: 1.27 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)C)NC(=O)OC(C)(C)C
  • InChi: 1S/C19H33N3O6S/c1-12(17(25)26)20-15(23)13-6-9-22(10-7-13)16(24)14(8-11-29-5)21-18(27)28-19(2,3)4/h12-14H,6-11H2,1-5H3,(H,20,23)(H,21,27)(H,25,26)/t12-,14-/m0/s1
  • InChiKey: KOWXEOKQUJEIQD-JSGCOSHPSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2S)-2-[[1-[(2S)-2-(tert-butoxycarbonylamino)-4-methylsulfanyl-butanoyl]piperidine-4-carbonyl]amino]propanoic acid
  • (2S)-2-[[[1-[(2S)-2-[(tert-butoxy-oxomethyl)amino]-4-(methylthio)-1-oxobutyl]-4-piperidinyl]-oxomethyl]amino]propanoic acid
  • (2S)-2-[[1-[(2S)-2-(tert-butoxycarbonylamino)-4-(methylthio)butanoyl]piperidine-4-carbonyl]amino]propionic acid
  • (2S)-2-[[1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoyl]piperidin-4-yl]carbonylamino]propanoic acid
  • STOCK4S-41111
  • MLS000040968
  • SMR000044446

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
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 multilocularis neuropeptide s receptor 0.0029 0.0876 0.0876
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0129 0.0224
Echinococcus granulosus hypothetical protein 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0876 0.0876
Echinococcus granulosus sex peptide receptor 0.0029 0.0876 0.1043
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0876 0.0876
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0129 0.0224
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0876 0.0876
Brugia malayi hypothetical protein 0.0036 0.1406 0.2448
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0029 0.0876 0.0876
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0129 0.0153
Brugia malayi G-protein coupled receptor 0.0029 0.0876 0.1525
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0876 0.1043
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0876 0.0876
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.1406 0.1406
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0876 0.0876
Brugia malayi neuropeptide F receptor 0.0029 0.0876 0.1525
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0129 0.0224
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0876 0.1043
Onchocerca volvulus 0.0029 0.0876 1
Schistosoma mansoni biogenic amine receptor 0.0029 0.0876 0.0876
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0124 0.8396 0.8396
Schistosoma mansoni tar DNA-binding protein 0.0076 0.4639 0.4639
Brugia malayi G-protein coupled receptor 0.0029 0.0876 0.1525
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0129 0.0153
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0876 0.0876
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.0129 0.0224
Schistosoma mansoni opsin-like receptor 0.0029 0.0876 0.0876
Onchocerca volvulus 0.0029 0.0876 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0129 0.0153
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0876 0.1043
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni hypothetical protein 0.0029 0.0876 0.0876
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0129 0.0224
Onchocerca volvulus 0.0029 0.0876 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Entamoeba histolytica hypothetical protein 0.0036 0.1406 1
Onchocerca volvulus 0.0029 0.0876 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0129 0.0153
Loa Loa (eye worm) RNA binding protein 0.0076 0.4639 0.8075
Schistosoma mansoni biogenic amine (5HT) receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0029 0.0876 0.0876
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0876 0.1043
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0129 0.0224
Schistosoma mansoni biogenic amine (5HT) receptor 0.0029 0.0876 0.0876
Echinococcus multilocularis tar DNA binding protein 0.0076 0.4639 0.4639
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0129 0.0153
Brugia malayi Serotonin receptor 0.0029 0.0876 0.1525
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0129 0.0224
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi ORL1-like opioid receptor 0.0029 0.0876 0.1525
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.5745 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0029 0.0876 0.0876
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0029 0.0876 0.1525
Echinococcus granulosus allatostatin A receptor 0.0029 0.0876 0.1043
Schistosoma mansoni hypothetical protein 0.0029 0.0876 0.0876
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0876 0.0876
Schistosoma mansoni tar DNA-binding protein 0.0076 0.4639 0.4639
Brugia malayi sulfakinin receptor protein 0.0029 0.0876 0.1525
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0029 0.0876 0.0876
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.1406 0.1675
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.5745 0.5745
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) melatonin receptor type 1A 0.0029 0.0876 0.1525
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0876 0.0876
Schistosoma mansoni coup transcription factor 0.002 0.0129 0.0129
Schistosoma mansoni hypothetical protein 0.0124 0.8396 0.8396
Onchocerca volvulus 0.0029 0.0876 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni amine GPCR 0.0029 0.0876 0.0876
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0876 0.0876
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0029 0.0876 0.0876
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0029 0.0876 0.0876
Onchocerca volvulus 0.0029 0.0876 1
Schistosoma mansoni opsin-like receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus neuropeptide receptor A26 0.0029 0.0876 0.1043
Echinococcus granulosus tachykinin peptides receptor 99D 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi steroid hormone receptor 0.002 0.0129 0.0224
Schistosoma mansoni hypothetical protein 0.0036 0.1406 0.1406
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0129 0.0224
Onchocerca volvulus 0.0029 0.0876 1
Onchocerca volvulus 0.0029 0.0876 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Entamoeba histolytica hypothetical protein 0.0036 0.1406 1
Onchocerca volvulus 0.0029 0.0876 1
Echinococcus multilocularis serotonin receptor 0.0029 0.0876 0.0876
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0029 0.0876 0.1525
Brugia malayi Tachykinin-like peptides receptor 99D 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Echinococcus granulosus alpha 1A adrenergic receptor 0.0029 0.0876 0.1043
Schistosoma mansoni amine GPCR 0.0029 0.0876 0.0876
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0129 0.0224
Schistosoma mansoni hypothetical protein 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0029 0.0876 1
Entamoeba histolytica hypothetical protein 0.0036 0.1406 1
Schistosoma mansoni adenoreceptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0129 0.0129
Brugia malayi RE15519p 0.0029 0.0876 0.1525
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.5745 0.6842
Brugia malayi Dopamine receptor 0.0029 0.0876 0.1525
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0129 0.0224
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni histamine h1 receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis neuropeptide FF receptor 2 0.0029 0.0876 0.0876
Echinococcus granulosus biogenic amine 5HT receptor 0.0029 0.0876 0.1043
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0876 0.1043
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0129 0.0129
Echinococcus multilocularis sex peptide receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0029 0.0876 0.0876
Echinococcus granulosus 7tm_1 domain containing protein 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0876 0.1043
Echinococcus granulosus 7TM GPCR rhodopsin 0.0029 0.0876 0.1043
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0129 0.0224
Onchocerca volvulus 0.0029 0.0876 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0029 0.0876 0.1525
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0876 0.0876
Echinococcus granulosus g-protein coupled receptor 0.0029 0.0876 0.1043
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0129 0.0153
Echinococcus granulosus neuropeptide receptor 0.0029 0.0876 0.1043
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0876 0.0876
Schistosoma mansoni amine GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0876 0.0876
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0876 0.0876
Brugia malayi Dopamine receptor protein 2 0.0029 0.0876 0.1525
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0876 0.0876
Brugia malayi TAR-binding protein 0.0076 0.4639 0.8075
Echinococcus multilocularis orexin receptor type 2 0.0029 0.0876 0.0876
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0876 0.0876
Schistosoma mansoni nuclear hormone receptor 0.002 0.0129 0.0129
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0876 0.0876
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0876 0.0876
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.4639 0.8075
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.5745 0.5745
Echinococcus granulosus neuropeptide FF receptor 2 0.0029 0.0876 0.1043
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0029 0.0876 0.1525
Schistosoma mansoni growth hormone secretagogue receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0029 0.0876 0.1525
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.5745 0.5745
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0129 0.0129
Echinococcus granulosus neuropeptide receptor 0.0029 0.0876 0.1043
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) TYRA-2 protein 0.0029 0.0876 0.1525
Echinococcus granulosus FTZ F1 alpha 0.002 0.0129 0.0153
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Onchocerca volvulus 0.0029 0.0876 1
Schistosoma mansoni myosin xvIII 0.0029 0.0876 0.0876
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0129 0.0129
Echinococcus multilocularis dro:myosuppressin receptor 0.0029 0.0876 0.0876
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.1406 0.1406
Echinococcus granulosus fmrfamide receptor 0.0029 0.0876 0.1043
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0129 0.0129
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Brugia malayi larval opioid receptor 0.0029 0.0876 0.1525
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0029 0.0876 0.0876
Brugia malayi putative neuropeptide receptor NPR1 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi ecdysteroid receptor 0.002 0.0129 0.0224
Brugia malayi Dopamine receptor protein 1 0.0029 0.0876 0.1525
Schistosoma mansoni biogenic amine receptor 0.0029 0.0876 0.0876
Onchocerca volvulus Neuropeptide F receptor homolog 0.0029 0.0876 1
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0876 0.1525
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0129 0.0224
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0129 0.0129
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0129 0.0224
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0129 0.0224
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0876 0.0876
Brugia malayi GnHR receptor homolog 0.0029 0.0876 0.1525
Schistosoma mansoni amine GPCR 0.0029 0.0876 0.0876
Onchocerca volvulus 0.0029 0.0876 1
Brugia malayi nuclear hormone receptor 0.002 0.0129 0.0224
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0129 0.0153
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi AKH receptor 0.0029 0.0876 0.1525
Onchocerca volvulus 0.0029 0.0876 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0029 0.0876 0.0876
Brugia malayi nuclear receptor NHR-88 0.002 0.0129 0.0224
Echinococcus granulosus serotonin receptor 0.0029 0.0876 0.1043
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0029 0.0876 0.1525
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0129 0.0224
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Schistosoma mansoni neuropeptide receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0876 0.1525
Schistosoma mansoni alpha-1 adrenergic receptor 0.0029 0.0876 0.0876
Schistosoma mansoni hypothetical protein 0.0029 0.0876 0.0876
Entamoeba histolytica hypothetical protein 0.0036 0.1406 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0876 0.1043
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0129 0.0129
Echinococcus multilocularis somatostatin receptor 0.0029 0.0876 0.0876
Echinococcus granulosus dro:myosuppressin receptor 0.0029 0.0876 0.1043
Echinococcus granulosus peptide allatostatin:somatostatin 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0129 0.0129
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0129 0.0224
Echinococcus granulosus neuropeptide s receptor 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0129 0.0224
Brugia malayi putative neuropeptide receptor 0.0029 0.0876 0.1525
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Schistosoma mansoni neuropeptide receptor 0.0029 0.0876 0.0876
Brugia malayi RNA binding protein 0.0076 0.4639 0.8075
Echinococcus multilocularis G-protein coupled receptor, putative 0.0029 0.0876 0.0876
Echinococcus multilocularis g-protein coupled receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0129 0.0153
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis G protein coupled receptor 139 0.0029 0.0876 0.0876
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0129 0.0129
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0876 0.1043
Schistosoma mansoni opsin-like receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.4639 0.8075
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0029 0.0876 0.0876
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0029 0.0876 0.0876
Echinococcus granulosus orexin receptor type 2 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Onchocerca volvulus 0.0029 0.0876 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni tar DNA-binding protein 0.0076 0.4639 0.4639
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.5745 0.5745
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.5745 0.6842
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Schistosoma mansoni neuropeptide receptor 0.0029 0.0876 0.0876
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0029 0.0876 0.1043
Schistosoma mansoni biogenic amine receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0129 0.0224
Brugia malayi neuropeptide F receptor 0.0029 0.0876 0.1525
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0129 0.0224
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0129 0.0129
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0876 0.0876
Brugia malayi Serotonin receptor 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.5745 0.5745
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0129 0.0224
Echinococcus multilocularis allatostatin A receptor 0.0029 0.0876 0.0876
Echinococcus multilocularis serotonin receptor 0.0029 0.0876 0.0876
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0129 0.0129
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Echinococcus granulosus g protein coupled receptor 0.0029 0.0876 0.1043
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.5745 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0029 0.0876 0.1525
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0029 0.0876 0.1525
Echinococcus granulosus G protein coupled receptor 139 0.0029 0.0876 0.1043
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Brugia malayi Melatonin receptor type 1A 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus biogenic amine 5HT receptor 0.0029 0.0876 0.1043
Onchocerca volvulus 0.0029 0.0876 1
Schistosoma mansoni amine GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0029 0.0876 0.1525
Echinococcus multilocularis neuropeptide receptor A26 0.0029 0.0876 0.0876
Echinococcus granulosus g protein coupled receptor 0.0029 0.0876 0.1043
Schistosoma mansoni neuropeptide receptor 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Onchocerca volvulus 0.0029 0.0876 1
Brugia malayi follicle stimulating hormone receptor 0.0029 0.0876 0.1525
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0876 0.1525
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0129 0.0224
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0029 0.0876 0.0876
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Loa Loa (eye worm) TAR-binding protein 0.0076 0.4639 0.8075
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0129 0.0224
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0129 0.0129
Echinococcus granulosus g protein coupled receptor 0.0029 0.0876 0.1043
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0876 0.0876
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0124 0.8396 1
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus somatostatin receptor 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0876 0.0876
Loa Loa (eye worm) hypothetical protein 0.0029 0.0876 0.1525
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0876 0.1043
Loa Loa (eye worm) hypothetical protein 0.002 0.0129 0.0224
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0129 0.0224
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0129 0.0129
Schistosoma mansoni tar DNA-binding protein 0.0076 0.4639 0.4639
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0129 0.0129
Onchocerca volvulus 0.0029 0.0876 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0029 0.0876 0.0876
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0029 0.0876 0.0876
Schistosoma mansoni tar DNA-binding protein 0.0076 0.4639 0.4639
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0876 0.0876
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0876 0.1043
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0029 0.0876 0.1043
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0029 0.0876 0.0876
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0129 0.0129
Brugia malayi hypothetical protein 0.0029 0.0876 0.1525
Brugia malayi G protein-coupled receptor F59B2.13 0.0029 0.0876 0.1525
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0129 0.0129
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0129 0.0129
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0129 0.0224
Brugia malayi G protein-coupled receptor 0.0029 0.0876 0.1525
Echinococcus granulosus tar DNA binding protein 0.0076 0.4639 0.5524

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0465 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) 0.5623 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) 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) 79.4328 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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