Detailed information for compound 1407472

Basic information

Technical information
  • TDR Targets ID: 1407472
  • Name: 1-ethyl-3-hydroxy-3-[2-oxo-2-(3-pyrrol-1-ylph enyl)ethyl]indol-2-one
  • MW: 360.406 | Formula: C22H20N2O3
  • H donors: 1 H acceptors: 3 LogP: 2.85 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN1c2ccccc2C(C1=O)(O)CC(=O)c1cccc(c1)n1cccc1
  • InChi: 1S/C22H20N2O3/c1-2-24-19-11-4-3-10-18(19)22(27,21(24)26)15-20(25)16-8-7-9-17(14-16)23-12-5-6-13-23/h3-14,27H,2,15H2,1H3
  • InChiKey: VSSLXHINMFNZPM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-ethyl-3-hydroxy-3-[2-oxo-2-(3-pyrrol-1-ylphenyl)ethyl]indolin-2-one
  • 1-ethyl-3-hydroxy-3-[2-oxo-2-[3-(1-pyrrolyl)phenyl]ethyl]-2-indolinone
  • 1-ethyl-3-hydroxy-3-[2-keto-2-(3-pyrrol-1-ylphenyl)ethyl]oxindole
  • MLS000683859
  • SMR000295582
  • 1-ethyl-3-hydroxy-3-{2-oxo-2-[3-(1H-pyrrol-1-yl)phenyl]ethyl}-1,3-dihydro-2H-indol-2-one

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi GnHR receptor homolog 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0229 0.2422 0.2713
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni myosin xvIII 0.0067 0.039 0.039
Echinococcus granulosus tm gpcr rhodopsin 0.0067 0.039 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0067 0.039 0.039
Loa Loa (eye worm) melatonin receptor type 1A 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis neuropeptides capa receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni biogenic amine (5HT) receptor 0.0067 0.039 0.039
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0466 0.0355
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Schistosoma mansoni amine GPCR 0.0067 0.039 0.039
Brugia malayi Dopamine receptor protein 1 0.0067 0.039 0.0322
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0067 0.039 0.0277
Echinococcus multilocularis neuropeptide Y receptor 0.0067 0.039 0.0277
Echinococcus granulosus dro:myosuppressin receptor 0.0067 0.039 0.0277
Echinococcus multilocularis g protein coupled receptor 0.0067 0.039 0.0277
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0067 0.039 0.0277
Schistosoma mansoni biogenic amine receptor 0.0067 0.039 0.039
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0199 0.2042 0.2266
Brugia malayi AKH receptor 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0066 0.038 0.0311
Schistosoma mansoni neuropeptide F-like receptor 0.0067 0.039 0.039
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni amine GPCR 0.0067 0.039 0.039
Schistosoma mansoni voltage-gated potassium channel 0.025 0.2686 0.2686
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0466 0.5
Onchocerca volvulus 0.0067 0.039 0.5
Onchocerca volvulus Neuropeptide F receptor homolog 0.0067 0.039 0.5
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0067 0.039 0.0322
Loa Loa (eye worm) G-protein coupled receptor 0.0067 0.039 0.0322
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0067 0.039 0.0277
Echinococcus granulosus neuropeptides capa receptor 0.0067 0.039 0.0277
Echinococcus granulosus 7TM GPCR rhodopsin 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0045 0.0116 0.0116
Echinococcus multilocularis sex peptide receptor 0.0067 0.039 0.0277
Echinococcus granulosus neuropeptide Y receptor 0.0067 0.039 0.0277
Schistosoma mansoni opsin-like receptor 0.0067 0.039 0.039
Schistosoma mansoni amine GPCR 0.0067 0.039 0.039
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0067 0.039 0.039
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis G protein coupled receptor 139 0.0067 0.039 0.0277
Echinococcus granulosus sex peptide receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni voltage-gated potassium channel 0.0066 0.038 0.038
Echinococcus multilocularis neuropeptide FF receptor 2 0.0067 0.039 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0269 0.2925 0.2843
Brugia malayi Dopamine receptor protein 2 0.0067 0.039 0.0322
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0067 0.039 0.0322
Schistosoma mansoni adenoreceptor 0.0067 0.039 0.039
Echinococcus granulosus alpha 1A adrenergic receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0067 0.039 0.039
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0067 0.039 0.0277
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0269 0.2925 0.2925
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0067 0.039 0.0277
Schistosoma mansoni biogenic amine receptor 0.0067 0.039 0.039
Schistosoma mansoni amine GPCR 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0067 0.039 0.039
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni hypothetical protein 0.0067 0.039 0.039
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0066 0.038 0.0267
Schistosoma mansoni biogenic amine receptor 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Echinococcus multilocularis serotonin receptor 0.0067 0.039 0.0277
Echinococcus granulosus neuropeptides capa receptor 0.0067 0.039 0.0277
Echinococcus multilocularis somatostatin receptor 0.0067 0.039 0.0277
Echinococcus multilocularis allatostatin A receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus neuropeptide s receptor 0.0067 0.039 0.0277
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis fmrfamide receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus g-protein coupled receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0067 0.039 0.039
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0067 0.039 0.0277
Schistosoma mansoni growth hormone secretagogue receptor 0.0067 0.039 0.039
Echinococcus multilocularis orexin receptor type 2 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus granulosus voltage gated potassium channel 0.0066 0.038 0.0267
Brugia malayi G protein-coupled receptor F59B2.13 0.0067 0.039 0.0322
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0214 0.2233 1
Brugia malayi ORL1-like opioid receptor 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi putative neuropeptide receptor 0.0067 0.039 0.0322
Echinococcus multilocularis G-protein coupled receptor, putative 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus peptide allatostatin:somatostatin 0.0067 0.039 0.0277
Echinococcus granulosus leukotriene A 4 hydrolase 0.0269 0.2925 0.2843
Schistosoma mansoni neuropeptide receptor 0.0067 0.039 0.039
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0466 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0229 0.2422 0.2713
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus granulosus somatostatin receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.0723 0.8618 1
Echinococcus granulosus neuropeptide receptor A26 0.0067 0.039 0.0277
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0466 0.5
Echinococcus multilocularis fmrfamide receptor 0.0067 0.039 0.0277
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0066 0.038 0.0267
Schistosoma mansoni alpha-1 adrenergic receptor 0.0067 0.039 0.039
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0067 0.039 0.0277
Schistosoma mansoni voltage-gated potassium channel 0.0045 0.0116 0.0116
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0067 0.039 0.0277
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus biogenic amine 5HT receptor 0.0067 0.039 0.0277
Echinococcus multilocularis voltage gated potassium channel 0.0066 0.038 0.0267
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis serotonin receptor 0.0067 0.039 0.0277
Brugia malayi neuropeptide F receptor 0.0067 0.039 0.0322
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0466 0.5
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0045 0.0116 0.0116
Echinococcus multilocularis dro:myosuppressin receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus G protein coupled receptor 139 0.0067 0.039 0.0277
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0045 0.0116 0.0116
Echinococcus granulosus allatostatin A receptor 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Schistosoma mansoni hypothetical protein 0.0067 0.039 0.039
Onchocerca volvulus 0.0067 0.039 0.5
Schistosoma mansoni neuropeptide receptor 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni neuropeptide receptor 0.0067 0.039 0.039
Echinococcus granulosus tm gpcr rhodopsin 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus 7tm_1 domain containing protein 0.0067 0.039 0.0277
Schistosoma mansoni neuropeptide f receptor 76f 0.0067 0.039 0.039
Schistosoma mansoni neuropeptide F-like receptor 0.0067 0.039 0.039
Loa Loa (eye worm) G-protein coupled receptor 0.0067 0.039 0.0322
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis neuropeptide Y receptor 0.0067 0.039 0.0277
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0045 0.0116 0.0116
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0466 0.0355
Echinococcus multilocularis neuropeptide receptor 0.0067 0.039 0.0277
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0214 0.2233 1
Brugia malayi G-protein coupled receptor 0.0067 0.039 0.0322
Echinococcus granulosus tm gpcr rhodopsin 0.0067 0.039 0.0277
Schistosoma mansoni biogenic amine (5HT) receptor 0.0067 0.039 0.039
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0067 0.039 0.039
Echinococcus granulosus g protein coupled receptor 0.0067 0.039 0.0277
Brugia malayi Dopamine receptor 0.0067 0.039 0.0322
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0466 0.5
Echinococcus granulosus g protein coupled receptor 0.0067 0.039 0.0277
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0466 0.0466
Echinococcus granulosus orexin receptor type 2 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis neuropeptide s receptor 0.0067 0.039 0.0277
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0067 0.039 0.0322
Brugia malayi putative neuropeptide receptor NPR1 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Brugia malayi Angiotensin-converting enzyme family protein 0.0723 0.8618 1
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi Melatonin receptor type 1A 0.0067 0.039 0.0322
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Schistosoma mansoni neuropeptide receptor 0.0067 0.039 0.039
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0066 0.038 0.0311
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0067 0.039 0.0277
Echinococcus granulosus neuropeptide FF receptor 2 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis neuropeptide receptor 0.0067 0.039 0.0277
Schistosoma mansoni hypothetical protein 0.0067 0.039 0.039
Onchocerca volvulus 0.0067 0.039 0.5
Brugia malayi Tachykinin-like peptides receptor 99D 0.0067 0.039 0.0322
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0067 0.039 0.0277
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis g protein coupled receptor 0.0067 0.039 0.0277
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0045 0.0116 0.0116
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Brugia malayi follicle stimulating hormone receptor 0.0067 0.039 0.0322
Schistosoma mansoni opsin-like receptor 0.0067 0.039 0.039
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus granulosus neuropeptide Y receptor 0.0067 0.039 0.0277
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0067 0.039 0.039
Schistosoma mansoni voltage-gated potassium channel 0.025 0.2686 0.2686
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0067 0.039 0.0277
Brugia malayi G-protein coupled receptor 0.0067 0.039 0.0322
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0067 0.039 0.039
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Loa Loa (eye worm) TYRA-2 protein 0.0067 0.039 0.0322
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0229 0.2422 0.2333
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis g-protein coupled receptor 0.0067 0.039 0.0277
Echinococcus granulosus tachykinin peptides receptor 99D 0.0067 0.039 0.0277
Echinococcus granulosus g protein coupled receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus hypothetical protein 0.0067 0.039 0.0277
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi Serotonin receptor 0.0067 0.039 0.0322
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0067 0.039 0.039
Brugia malayi hypothetical protein 0.0124 0.11 0.1158
Schistosoma mansoni histamine h1 receptor 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni opsin-like receptor 0.0067 0.039 0.039
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0067 0.039 0.0277
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Brugia malayi sulfakinin receptor protein 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0229 0.2422 0.2333
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0466 0.0466
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0269 0.2925 0.3305
Brugia malayi larval opioid receptor 0.0067 0.039 0.0322
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Brugia malayi RE15519p 0.0067 0.039 0.0322
Loa Loa (eye worm) neuropeptide F receptor 0.0067 0.039 0.0322
Echinococcus granulosus biogenic amine 5HT receptor 0.0067 0.039 0.0277
Schistosoma mansoni amine GPCR 0.0067 0.039 0.039
Schistosoma mansoni hypothetical protein 0.0067 0.039 0.039
Brugia malayi Serotonin receptor 0.0067 0.039 0.0322
Echinococcus multilocularis g protein coupled receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Brugia malayi neuropeptide F receptor 0.0067 0.039 0.0322
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus granulosus neuropeptide receptor 0.0067 0.039 0.0277
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0466 0.5
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0067 0.039 0.0322
Echinococcus granulosus neuropeptide receptor 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Echinococcus granulosus fmrfamide receptor 0.0067 0.039 0.0277
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0067 0.039 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0067 0.039 0.0322
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0067 0.039 0.039
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0067 0.039 0.039
Echinococcus granulosus serotonin receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) neuropeptide F receptor 0.0067 0.039 0.0322
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0067 0.039 0.0277
Echinococcus multilocularis neuropeptides capa receptor 0.0067 0.039 0.0277
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0067 0.039 0.0322
Brugia malayi G protein-coupled receptor 0.0067 0.039 0.0322
Echinococcus granulosus rhodopsin orphan GPCR 0.0067 0.039 0.0277
Echinococcus multilocularis rhodopsin orphan GPCR 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5
Brugia malayi hypothetical protein 0.0067 0.039 0.0322
Echinococcus multilocularis neuropeptide receptor A26 0.0067 0.039 0.0277
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0067 0.039 0.0322
Schistosoma mansoni voltage-gated potassium channel 0.0066 0.038 0.038
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0067 0.039 0.0277
Onchocerca volvulus 0.0067 0.039 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 4.4668 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5962 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (functional) 32.6427 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 44.6684 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
Potency (functional) 112.2018 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) 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.

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