Detailed information for compound 1434687

Basic information

Technical information
  • TDR Targets ID: 1434687
  • Name: 4-methoxy-N-[4-[(4-methoxyphenyl)sulfonylamin o]butyl]benzenesulfonamide
  • MW: 428.523 | Formula: C18H24N2O6S2
  • H donors: 2 H acceptors: 4 LogP: 2.21 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)S(=O)(=O)NCCCCNS(=O)(=O)c1ccc(cc1)OC
  • InChi: 1S/C18H24N2O6S2/c1-25-15-5-9-17(10-6-15)27(21,22)19-13-3-4-14-20-28(23,24)18-11-7-16(26-2)8-12-18/h5-12,19-20H,3-4,13-14H2,1-2H3
  • InChiKey: WWJHVQIYHQVZCX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • MLS000088768
  • N,N'-1,4-butanediylbis(4-methoxybenzenesulfonamide)
  • SMR000071908
  • ZINC02748688
  • IVK/8192948

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 GNAS complex locus Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans aldehyde dehydrogenase 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
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase 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
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative 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
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani 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
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
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
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 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0037 0.2001 0.2695
Echinococcus granulosus peptide allatostatin:somatostatin 0.0037 0.2001 0.2695
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0037 0.2001 0.2695
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Onchocerca volvulus 0.0037 0.2001 0.5
Onchocerca volvulus 0.0037 0.2001 0.5
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.724 0.9752
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.2001 0.2695
Schistosoma mansoni growth hormone secretagogue receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni amine GPCR 0.0037 0.2001 0.2537
Entamoeba histolytica hypothetical protein 0.0043 0.2959 0.5
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.2001 0.2695
Schistosoma mansoni neuropeptide receptor 0.0037 0.2001 0.2537
Schistosoma mansoni histamine h1 receptor 0.0037 0.2001 0.2537
Brugia malayi follicle stimulating hormone receptor 0.0037 0.2001 0.1149
Echinococcus granulosus neuropeptides capa receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni neuropeptide receptor 0.0037 0.2001 0.2537
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.4721 0.636
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0037 0.2001 0.2003
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis neuropeptide FF receptor 2 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Entamoeba histolytica hypothetical protein 0.0043 0.2959 0.5
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0535 0.0721
Echinococcus granulosus neuropeptide Y receptor 0.0037 0.2001 0.2695
Schistosoma mansoni amine GPCR 0.0037 0.2001 0.2537
Echinococcus granulosus neuropeptide Y receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) neuropeptide F receptor 0.0037 0.2001 0.2003
Brugia malayi GnHR receptor homolog 0.0037 0.2001 0.1149
Schistosoma mansoni opsin-like receptor 0.0037 0.2001 0.2537
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.2951 0.3975
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.2001 0.2537
Echinococcus multilocularis G protein coupled receptor 139 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037 0.2001 0.2537
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0037 0.2001 0.1149
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis g protein coupled receptor 0.0037 0.2001 0.2695
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Brugia malayi Melatonin receptor type 1A 0.0037 0.2001 0.1149
Echinococcus granulosus G protein coupled receptor 139 0.0037 0.2001 0.2695
Schistosoma mansoni biogenic amine receptor 0.0037 0.2001 0.2537
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0037 0.2001 0.2537
Echinococcus granulosus serotonin receptor 0.0037 0.2001 0.2695
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.4721 0.636
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Schistosoma mansoni opsin-like receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0085 0.9228 1
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.2001 0.2695
Onchocerca volvulus 0.0037 0.2001 0.5
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Schistosoma mansoni hypothetical protein 0.0025 0.0191 0.0242
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Brugia malayi putative neuropeptide receptor NPR1 0.0037 0.2001 0.1149
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Entamoeba histolytica hypothetical protein 0.0043 0.2959 0.5
Echinococcus granulosus neuropeptide receptor 0.0037 0.2001 0.2695
Echinococcus granulosus 7tm_1 domain containing protein 0.0037 0.2001 0.2695
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.4721 0.5987
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0037 0.2001 0.2695
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0037 0.2001 0.1149
Echinococcus multilocularis dro:myosuppressin receptor 0.0037 0.2001 0.2695
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0535 0.0679
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.2959 0.3753
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus g protein coupled receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis serotonin receptor 0.0037 0.2001 0.2695
Brugia malayi larval opioid receptor 0.0037 0.2001 0.1149
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni hypothetical protein 0.0037 0.2001 0.2537
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0037 0.2001 0.2695
Schistosoma mansoni biogenic amine receptor 0.0037 0.2001 0.2537
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Echinococcus multilocularis sex peptide receptor 0.0037 0.2001 0.2695
Echinococcus granulosus neuropeptide FF receptor 2 0.0037 0.2001 0.2695
Brugia malayi Tachykinin-like peptides receptor 99D 0.0037 0.2001 0.1149
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037 0.2001 0.2537
Echinococcus multilocularis G-protein coupled receptor, putative 0.0037 0.2001 0.2695
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037 0.2001 0.2695
Onchocerca volvulus 0.0037 0.2001 0.5
Loa Loa (eye worm) G-protein coupled receptor 0.0037 0.2001 0.2003
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.724 0.9752
Echinococcus multilocularis g protein coupled receptor 0.0037 0.2001 0.2695
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.7424 0.9414
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.4721 0.5013
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni amine GPCR 0.0037 0.2001 0.2537
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.2959 0.3986
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni neuropeptide F-like receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0037 0.2001 0.1149
Echinococcus granulosus neuropeptide s receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0037 0.2001 0.2695
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0037 0.2001 0.2003
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037 0.2001 0.2537
Echinococcus granulosus g protein coupled receptor 0.0037 0.2001 0.2695
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Schistosoma mansoni amine GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus alpha 1A adrenergic receptor 0.0037 0.2001 0.2695
Schistosoma mansoni opsin-like receptor 0.0037 0.2001 0.2537
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.2951 0.3975
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.4721 0.636
Echinococcus granulosus tachykinin peptides receptor 99D 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.7424 1
Brugia malayi AKH receptor 0.0037 0.2001 0.1149
Schistosoma mansoni hypothetical protein 0.0043 0.2959 0.3753
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0037 0.2001 0.2695
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0037 0.2001 0.2003
Echinococcus granulosus g protein coupled receptor 0.0037 0.2001 0.2695
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0037 0.2001 0.1149
Echinococcus granulosus neuropeptide receptor 0.0037 0.2001 0.2695
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.7424 0.5
Echinococcus multilocularis neuropeptides capa receptor 0.0037 0.2001 0.2695
Echinococcus granulosus allatostatin A receptor 0.0037 0.2001 0.2695
Echinococcus granulosus neuropeptide receptor A26 0.0037 0.2001 0.2695
Schistosoma mansoni adenoreceptor 0.0037 0.2001 0.2537
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037 0.2001 0.2695
Echinococcus granulosus g-protein coupled receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Onchocerca volvulus Neuropeptide F receptor homolog 0.0037 0.2001 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.0037 0.2001 0.2003
Brugia malayi ORL1-like opioid receptor 0.0037 0.2001 0.1149
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Onchocerca volvulus 0.0037 0.2001 0.5
Brugia malayi G-protein coupled receptor 0.0037 0.2001 0.1149
Onchocerca volvulus 0.0037 0.2001 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.7424 0.5
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0037 0.2001 0.2537
Schistosoma mansoni neuropeptide receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus orexin receptor type 2 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus granulosus biogenic amine 5HT receptor 0.0037 0.2001 0.2695
Echinococcus granulosus fmrfamide receptor 0.0037 0.2001 0.2695
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0037 0.2001 0.2537
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0037 0.2001 0.2537
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0037 0.2001 0.2695
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Echinococcus granulosus sex peptide receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Entamoeba histolytica hypothetical protein 0.0043 0.2959 0.5
Echinococcus multilocularis g protein coupled receptor 0.0037 0.2001 0.2695
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.2001 0.2695
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus granulosus 7TM GPCR rhodopsin 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0037 0.2001 0.2537
Onchocerca volvulus 0.0037 0.2001 0.5
Onchocerca volvulus 0.0037 0.2001 0.5
Schistosoma mansoni myosin xvIII 0.0037 0.2001 0.2537
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Onchocerca volvulus 0.0037 0.2001 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.4721 0.5987
Schistosoma mansoni biogenic amine receptor 0.0037 0.2001 0.2537
Brugia malayi G-protein coupled receptor 0.0037 0.2001 0.1149
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Brugia malayi G protein-coupled receptor 0.0037 0.2001 0.1149
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Brugia malayi Dopamine receptor protein 2 0.0037 0.2001 0.1149
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.7424 0.9414
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0037 0.2001 0.1149
Echinococcus multilocularis neuropeptide s receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0049 0.3818 0.4014
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.7424 0.5
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037 0.2001 0.2537
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.4721 0.5987
Brugia malayi Serotonin receptor 0.0037 0.2001 0.1149
Schistosoma mansoni bromodomain containing protein 0.0076 0.7886 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis neuropeptides capa receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis orexin receptor type 2 0.0037 0.2001 0.2695
Echinococcus multilocularis allatostatin A receptor 0.0037 0.2001 0.2695
Brugia malayi G protein-coupled receptor F59B2.13 0.0037 0.2001 0.1149
Echinococcus multilocularis neuropeptide Y receptor 0.0037 0.2001 0.2695
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Brugia malayi sulfakinin receptor protein 0.0037 0.2001 0.1149
Brugia malayi Serotonin receptor 0.0037 0.2001 0.1149
Echinococcus multilocularis neuropeptide Y receptor 0.0037 0.2001 0.2695
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0037 0.2001 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.7424 0.5
Brugia malayi neuropeptide F receptor 0.0037 0.2001 0.1149
Echinococcus multilocularis neuropeptide receptor A26 0.0037 0.2001 0.2695
Echinococcus multilocularis somatostatin receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.2001 0.2695
Loa Loa (eye worm) melatonin receptor type 1A 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.7424 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.4721 0.4159
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Onchocerca volvulus 0.0037 0.2001 0.5
Onchocerca volvulus 0.0037 0.2001 0.5
Onchocerca volvulus 0.0037 0.2001 0.5
Echinococcus multilocularis g-protein coupled receptor 0.0037 0.2001 0.2695
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Onchocerca volvulus 0.0037 0.2001 0.5
Loa Loa (eye worm) TYRA-2 protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0052 0.4163 0.4395
Brugia malayi RE15519p 0.0037 0.2001 0.1149
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0037 0.2001 0.2537
Schistosoma mansoni hypothetical protein 0.0037 0.2001 0.2537
Schistosoma mansoni hypothetical protein 0.0037 0.2001 0.2537
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus granulosus somatostatin receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0037 0.2001 0.2695
Schistosoma mansoni neuropeptide f receptor 76f 0.0037 0.2001 0.2537
Echinococcus granulosus dro:myosuppressin receptor 0.0037 0.2001 0.2695
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis neuropeptide receptor 0.0037 0.2001 0.2695
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.7424 0.5
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0535 0.0721
Echinococcus multilocularis serotonin receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.2959 0.3986
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0037 0.2001 0.2695
Brugia malayi hypothetical protein 0.0043 0.2959 0.2209
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.7424 0.5
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus multilocularis fmrfamide receptor 0.0037 0.2001 0.2695
Brugia malayi putative neuropeptide receptor 0.0037 0.2001 0.1149
Schistosoma mansoni amine GPCR 0.0037 0.2001 0.2537
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) G-protein coupled receptor 0.0037 0.2001 0.2003
Echinococcus multilocularis fmrfamide receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.2001 0.2695
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.4721 0.636
Schistosoma mansoni neuropeptide receptor 0.0037 0.2001 0.2537
Echinococcus granulosus neuropeptides capa receptor 0.0037 0.2001 0.2695
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0037 0.2001 0.2695
Onchocerca volvulus 0.0037 0.2001 0.5
Schistosoma mansoni alpha-1 adrenergic receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037 0.2001 0.2695
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0037 0.2001 0.2003
Onchocerca volvulus 0.0037 0.2001 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0046 0.3391 0.3541
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0037 0.2001 0.2695
Brugia malayi Bromodomain containing protein 0.0046 0.3378 0.2673
Echinococcus granulosus hypothetical protein 0.0037 0.2001 0.2695
Brugia malayi neuropeptide F receptor 0.0037 0.2001 0.1149
Brugia malayi hypothetical protein 0.0037 0.2001 0.1149
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Onchocerca volvulus 0.0037 0.2001 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037 0.2001 0.2695
Onchocerca volvulus 0.0037 0.2001 0.5
Brugia malayi Dopamine receptor protein 1 0.0037 0.2001 0.1149
Brugia malayi Dopamine receptor 0.0037 0.2001 0.1149
Echinococcus multilocularis neuropeptide receptor 0.0037 0.2001 0.2695
Echinococcus granulosus biogenic amine 5HT receptor 0.0037 0.2001 0.2695
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.2001 0.2537
Loa Loa (eye worm) hypothetical protein 0.0037 0.2001 0.2003
Schistosoma mansoni hypothetical protein 0.0037 0.2001 0.2537

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 1.2589 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) 1.636 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 10 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) 95.2834 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (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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