Detailed information for compound 1314874

Basic information

Technical information
  • TDR Targets ID: 1314874
  • Name: N-(4-butylphenyl)-4-pyridin-2-ylpiperazine-1- carbothioamide
  • MW: 354.512 | Formula: C20H26N4S
  • H donors: 1 H acceptors: 1 LogP: 4.45 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCc1ccc(cc1)NC(=S)N1CCN(CC1)c1ccccn1
  • InChi: 1S/C20H26N4S/c1-2-3-6-17-8-10-18(11-9-17)22-20(25)24-15-13-23(14-16-24)19-7-4-5-12-21-19/h4-5,7-12H,2-3,6,13-16H2,1H3,(H,22,25)
  • InChiKey: AHLXBWQTVFQTKB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(4-butylphenyl)-4-(2-pyridyl)piperazine-1-carbothioamide
  • N-(4-butylphenyl)-4-(2-pyridyl)-1-piperazinecarbothioamide
  • N-(4-butylphenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide
  • STK143539
  • MLS001183878
  • SMR000502973
  • Oprea1_377829

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptide Y receptor 0.0069 0.1315 0.1886
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0069 0.1315 0.1886
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0069 0.1315 0.1528
Toxoplasma gondii glyceraldehyde-3-phosphate dehydrogenase GAPDH2 0.021 0.6974 1
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni opsin-like receptor 0.0069 0.1315 0.1886
Brugia malayi sulfakinin receptor protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 0.6457
Loa Loa (eye worm) glyceraldehyde 3-phosphate dehydrogenase 0.0138 0.4072 0.4729
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.8611 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Loa Loa (eye worm) G-protein coupled receptor 0.0069 0.1315 0.1528
Echinococcus granulosus neuropeptides capa receptor 0.0069 0.1315 0.1886
Schistosoma mansoni hypothetical protein 0.0069 0.1315 0.1886
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis orexin receptor type 2 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) melatonin receptor type 1A 0.0069 0.1315 0.1528
Echinococcus multilocularis neuropeptides capa receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptides capa receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.0138 0.4072 0.5839
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.021 0.6974 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0069 0.1315 0.1886
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0069 0.1315 0.1886
Echinococcus granulosus somatostatin receptor 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Mycobacterium tuberculosis Probable glyceraldehyde 3-phosphate dehydrogenase Gap (GAPDH) 0.0073 0.1465 0.5
Echinococcus multilocularis g-protein coupled receptor 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Mycobacterium ulcerans glyceraldehyde 3-phosphate dehydrogenase Gap 0.021 0.6974 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Echinococcus granulosus tm gpcr rhodopsin 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus neuropeptide receptor 0.0069 0.1315 0.1886
Wolbachia endosymbiont of Brugia malayi glyceraldehyde-3-phosphate dehydrogenase, GapA 0.021 0.6974 0.5
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0069 0.1315 0.1886
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 0.6457
Brugia malayi G-protein coupled receptor 0.0069 0.1315 0.1528
Echinococcus granulosus g protein coupled receptor 0.0069 0.1315 0.1886
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Trypanosoma cruzi glyceraldehyde-3-phosphate dehydrogenase, putative 0.0138 0.4067 0.4996
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.021 0.6974 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni amine GPCR 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni biogenic amine receptor 0.0069 0.1315 0.1886
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0204 0.0237
Onchocerca volvulus 0.0069 0.1315 0.1315
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni neuropeptide F-like receptor 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 1
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.021 0.6974 1
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0138 0.4072 0.3058
Brugia malayi putative neuropeptide receptor 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis neuropeptide Y receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Onchocerca volvulus 0.0069 0.1315 0.1315
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Brugia malayi Tachykinin-like peptides receptor 99D 0.0069 0.1315 0.1528
Echinococcus multilocularis fmrfamide receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis g protein coupled receptor 0.0069 0.1315 0.1886
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0069 0.1315 0.1528
Echinococcus granulosus peptide allatostatin:somatostatin 0.0069 0.1315 0.1886
Schistosoma mansoni hypothetical protein 0.0069 0.1315 0.1886
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0966 0.1122
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus granulosus g protein coupled receptor 0.0069 0.1315 0.1886
Echinococcus granulosus orexin receptor type 2 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0069 0.1315 0.1886
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 1
Loa Loa (eye worm) glyceraldehyde 3-phosphate dehydrogenase 0.0138 0.4072 0.4729
Brugia malayi follicle stimulating hormone receptor 0.0069 0.1315 0.1528
Trypanosoma cruzi glyceraldehyde-3-phosphate dehydrogenase, putative 0.0138 0.4067 0.4996
Brugia malayi neuropeptide F receptor 0.0069 0.1315 0.1528
Loa Loa (eye worm) TYRA-2 protein 0.0069 0.1315 0.1528
Brugia malayi Pre-SET motif family protein 0.0251 0.8611 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis dro:myosuppressin receptor 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni amine GPCR 0.0069 0.1315 0.1886
Echinococcus multilocularis sex peptide receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0069 0.1315 0.1886
Schistosoma mansoni histamine h1 receptor 0.0069 0.1315 0.1886
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.021 0.6974 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0966 0.1122
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 0.6457
Loa Loa (eye worm) glyceraldehyde-3-phosphate dehydrogenase 0.0145 0.4367 0.5071
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Echinococcus granulosus neuropeptide receptor A26 0.0069 0.1315 0.1886
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0069 0.1315 0.1886
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni hypothetical protein 0.0041 0.0204 0.0293
Schistosoma mansoni hypothetical protein 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni biogenic amine (5HT) receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Brugia malayi RE15519p 0.0069 0.1315 0.1528
Brugia malayi Dopamine receptor 0.0069 0.1315 0.1528
Brugia malayi putative neuropeptide receptor NPR1 0.0069 0.1315 0.1528
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus sex peptide receptor 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Loa Loa (eye worm) G-protein coupled receptor 0.0069 0.1315 0.1528
Echinococcus multilocularis fmrfamide receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.021 0.6974 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0069 0.1315 0.1886
Echinococcus granulosus neuropeptide Y receptor 0.0069 0.1315 0.1886
Brugia malayi Serotonin receptor 0.0069 0.1315 0.1528
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0069 0.1315 0.1886
Loa Loa (eye worm) glyceraldehyde-3-phosphate dehydrogenase 0.0145 0.4367 0.5071
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0069 0.1315 0.1528
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni amine GPCR 0.0069 0.1315 0.1886
Brugia malayi G protein-coupled receptor 0.0069 0.1315 0.1528
Echinococcus multilocularis serotonin receptor 0.0069 0.1315 0.1886
Brugia malayi Dopamine receptor protein 2 0.0069 0.1315 0.1528
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.021 0.6974 1
Plasmodium vivax glyceraldehyde-3-phosphate dehydrogenase, putative 0.021 0.6974 1
Echinococcus multilocularis serotonin receptor 0.0069 0.1315 0.1886
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptide receptor 0.0069 0.1315 0.1886
Schistosoma mansoni growth hormone secretagogue receptor 0.0069 0.1315 0.1886
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0069 0.1315 0.1528
Brugia malayi GnHR receptor homolog 0.0069 0.1315 0.1528
Schistosoma mansoni amine GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni neuropeptide receptor 0.0069 0.1315 0.1886
Schistosoma mansoni opsin-like receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0069 0.1315 0.1886
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.021 0.6974 1
Treponema pallidum glyceraldehyde 3-phosphate dehydrogenase (gap) 0.021 0.6974 0.5
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus granulosus G protein coupled receptor 139 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptide receptor A26 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0069 0.1315 0.1886
Echinococcus granulosus tm gpcr rhodopsin 0.0069 0.1315 0.1886
Echinococcus granulosus 7TM GPCR rhodopsin 0.0069 0.1315 0.1886
Brugia malayi Glyceraldehyde 3-phosphate dehydrogenase 0.0073 0.146 0.1696
Echinococcus multilocularis g protein coupled receptor 0.0069 0.1315 0.1886
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0069 0.1315 0.1886
Echinococcus granulosus neuropeptide receptor 0.0069 0.1315 0.1886
Onchocerca volvulus 0.0069 0.1315 0.1315
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0138 0.4072 0.3058
Echinococcus granulosus g-protein coupled receptor 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Brugia malayi Dopamine receptor protein 1 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Plasmodium falciparum glyceraldehyde-3-phosphate dehydrogenase 0.021 0.6974 0.5
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0069 0.1315 0.1886
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 0.6457
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus neuropeptide s receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0069 0.1315 0.1528
Loa Loa (eye worm) neuropeptide F receptor 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus g protein coupled receptor 0.0069 0.1315 0.1886
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 0.6457
Mycobacterium leprae Probable glyceraldehyde 3-phosphate dehydrogenase Gap (GAPDH) 0.0073 0.1465 0.5
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.021 0.6974 1
Echinococcus granulosus hypothetical protein 0.0069 0.1315 0.1886
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Brugia malayi larval opioid receptor 0.0069 0.1315 0.1528
Schistosoma mansoni neuropeptide receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni opsin-like receptor 0.0069 0.1315 0.1886
Echinococcus granulosus biogenic amine 5HT receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Echinococcus granulosus fmrfamide receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0069 0.1315 0.1886
Brugia malayi glyceraldehyde 3-phosphate dehydrogenase 0.0065 0.1165 0.1353
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Brugia malayi AKH receptor 0.0069 0.1315 0.1528
Schistosoma mansoni amine GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Echinococcus multilocularis G-protein coupled receptor, putative 0.0069 0.1315 0.1886
Echinococcus granulosus 7tm_1 domain containing protein 0.0069 0.1315 0.1886
Toxoplasma gondii glyceraldehyde-3-phosphate dehydrogenase GAPDH1 0.021 0.6974 1
Schistosoma mansoni myosin xvIII 0.0069 0.1315 0.1886
Brugia malayi neuropeptide F receptor 0.0069 0.1315 0.1528
Brugia malayi Serotonin receptor 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Chlamydia trachomatis glyceraldehyde-3-phosphate dehydrogenase 0.021 0.6974 0.5
Echinococcus granulosus alpha 1A adrenergic receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0069 0.1315 0.1886
Echinococcus granulosus tm gpcr rhodopsin 0.0069 0.1315 0.1886
Schistosoma mansoni biogenic amine (5HT) receptor 0.0069 0.1315 0.1886
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, cytosolic 0.021 0.6974 1
Brugia malayi Melatonin receptor type 1A 0.0069 0.1315 0.1528
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0069 0.1315 0.1886
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Schistosoma mansoni neuropeptide receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus multilocularis allatostatin A receptor 0.0069 0.1315 0.1886
Leishmania major glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.021 0.6974 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0966 0.1122
Onchocerca volvulus Neuropeptide F receptor homolog 0.0069 0.1315 0.1315
Schistosoma mansoni biogenic amine receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis somatostatin receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis G protein coupled receptor 139 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0041 0.0204 0.0237
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus neuropeptide FF receptor 2 0.0069 0.1315 0.1886
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.021 0.6974 1
Brugia malayi Glyceraldehyde 3-phosphate dehydrogenase 0.021 0.6974 0.8099
Brugia malayi G-protein coupled receptor 0.0069 0.1315 0.1528
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.021 0.6974 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0069 0.1315 0.1528
Echinococcus multilocularis g protein coupled receptor 0.0069 0.1315 0.1886
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.021 0.6974 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Giardia lamblia Glyceraldehyde 3-phosphate dehydrogenase 0.021 0.6974 1
Schistosoma mansoni hypothetical protein 0.0069 0.1315 0.1886
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0069 0.1315 0.1886
Echinococcus granulosus serotonin receptor 0.0069 0.1315 0.1886
Echinococcus granulosus neuropeptides capa receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni adenoreceptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.021 0.6974 0.5
Schistosoma mansoni biogenic amine receptor 0.0069 0.1315 0.1886
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0069 0.1315 0.1886
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Loa Loa (eye worm) neuropeptide F receptor 0.0069 0.1315 0.1528
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.021 0.6974 1
Echinococcus granulosus dro:myosuppressin receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.021 0.6974 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0069 0.1315 0.1528
Echinococcus multilocularis rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptide receptor 0.0069 0.1315 0.1886
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0069 0.1315 0.1528
Echinococcus granulosus rhodopsin orphan GPCR 0.0069 0.1315 0.1886
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.021 0.6974 1
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.021 0.6974 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0069 0.1315 0.1886
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0069 0.1315 0.1886
Echinococcus granulosus biogenic amine 5HT receptor 0.0069 0.1315 0.1886
Schistosoma mansoni neuropeptide f receptor 76f 0.0069 0.1315 0.1886
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.021 0.6974 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0069 0.1315 0.1315
Schistosoma mansoni alpha-1 adrenergic receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis neuropeptide FF receptor 2 0.0069 0.1315 0.1886
Schistosoma mansoni neuropeptide receptor 0.0069 0.1315 0.1886
Brugia malayi hypothetical protein 0.0069 0.1315 0.1528
Onchocerca volvulus 0.0069 0.1315 0.1315
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0069 0.1315 0.1886
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0069 0.1315 0.1886
Echinococcus granulosus allatostatin A receptor 0.0069 0.1315 0.1886
Brugia malayi ORL1-like opioid receptor 0.0069 0.1315 0.1528
Echinococcus granulosus tachykinin peptides receptor 99D 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.006 0.0966 0.1122
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.0138 0.4072 0.5839
Echinococcus multilocularis neuropeptide s receptor 0.0069 0.1315 0.1886
Leishmania major glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.021 0.6974 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528
Echinococcus granulosus neuropeptide Y receptor 0.0069 0.1315 0.1886
Loa Loa (eye worm) hypothetical protein 0.0138 0.4072 0.4729
Loa Loa (eye worm) hypothetical protein 0.0069 0.1315 0.1528

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.5849 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 2.8184 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 6.3096 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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) = 22.3872 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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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