Detailed information for compound 26135

Basic information

Technical information
  • TDR Targets ID: 26135
  • Name: [2,6-di(propan-2-yl)phenyl] N-(phenylsulfamoy l)carbamate
  • MW: 376.47 | Formula: C19H24N2O4S
  • H donors: 2 H acceptors: 3 LogP: 5.16 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NS(=O)(=O)Nc1ccccc1)Oc1c(cccc1C(C)C)C(C)C
  • InChi: 1S/C19H24N2O4S/c1-13(2)16-11-8-12-17(14(3)4)18(16)25-19(22)21-26(23,24)20-15-9-6-5-7-10-15/h5-14,20H,1-4H3,(H,21,22)
  • InChiKey: OPDGPYUVIVPEEU-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • (2,6-diisopropylphenyl) N-(phenylsulfamoyl)carbamate
  • N-(phenylsulfamoyl)carbamic acid (2,6-diisopropylphenyl) ester

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0074 0.0688 0.12
Brugia malayi sulfakinin receptor protein 0.0074 0.0688 0.12
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0074 0.0688 0.0238
Brugia malayi G-protein coupled receptor 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus multilocularis neuropeptides capa receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus neuropeptides capa receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) G-protein coupled receptor 0.0074 0.0688 0.0688
Echinococcus multilocularis dro:myosuppressin receptor 0.0074 0.0688 0.0238
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) neuropeptide F receptor 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0238 0.8738 0.8738
Echinococcus granulosus neuropeptide Y receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) G-protein coupled receptor 0.0074 0.0688 0.0688
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus granulosus 7TM GPCR rhodopsin 0.0074 0.0688 0.0238
Echinococcus multilocularis g protein coupled receptor 0.0074 0.0688 0.0238
Brugia malayi ORL1-like opioid receptor 0.0074 0.0688 0.12
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus granulosus fmrfamide receptor 0.0074 0.0688 0.0238
Echinococcus granulosus neuropeptide Y receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0074 0.0688 0.0688
Echinococcus multilocularis g protein coupled receptor 0.0074 0.0688 0.0238
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0177 0.5734 1
Brugia malayi Dopamine receptor 0.0074 0.0688 0.12
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0074 0.0688 0.0688
Brugia malayi neuropeptide F receptor 0.0074 0.0688 0.12
Echinococcus granulosus tm gpcr rhodopsin 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus granulosus g protein coupled receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0069 0.0461 0.5
Brugia malayi GnHR receptor homolog 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) TYRA-2 protein 0.0074 0.0688 0.0688
Echinococcus multilocularis sex peptide receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0074 0.0688 0.0688
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus biogenic amine 5HT receptor 0.0074 0.0688 0.0238
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Onchocerca volvulus 0.0074 0.0688 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0074 0.0688 0.0688
Brugia malayi Zinc finger, C2H2 type family protein 0.0069 0.0461 0.0805
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0074 0.0688 0.0238
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0074 0.0688 0.12
Brugia malayi Tachykinin-like peptides receptor 99D 0.0074 0.0688 0.12
Echinococcus multilocularis neuropeptides capa receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis neuropeptide Y receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0074 0.0688 0.0238
Echinococcus granulosus 7tm_1 domain containing protein 0.0074 0.0688 0.0238
Brugia malayi neuropeptide F receptor 0.0074 0.0688 0.12
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus multilocularis allatostatin A receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis g protein coupled receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus multilocularis somatostatin receptor 0.0074 0.0688 0.0238
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus multilocularis G-protein coupled receptor, putative 0.0074 0.0688 0.0238
Echinococcus granulosus alpha 1A adrenergic receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Echinococcus granulosus orexin receptor type 2 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0264 1 1
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0177 0.5734 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis fmrfamide receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis serotonin receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis serotonin receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus biogenic amine 5HT receptor 0.0074 0.0688 0.0238
Brugia malayi G protein-coupled receptor F59B2.13 0.0074 0.0688 0.12
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.0177 0.5734 0.5
Brugia malayi Dopamine receptor protein 2 0.0074 0.0688 0.12
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0069 0.0461 0.5
Brugia malayi putative neuropeptide receptor NPR1 0.0074 0.0688 0.12
Schistosoma mansoni dihydroorotate dehydrogenase 0.0177 0.5734 0.5418
Echinococcus granulosus g protein coupled receptor 0.0074 0.0688 0.0238
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0069 0.0461 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus dro:myosuppressin receptor 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Brugia malayi Serotonin receptor 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus g-protein coupled receptor 0.0074 0.0688 0.0238
Onchocerca volvulus Neuropeptide F receptor homolog 0.0074 0.0688 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0074 0.0688 0.12
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) melatonin receptor type 1A 0.0074 0.0688 0.0688
Echinococcus granulosus neuropeptide FF receptor 2 0.0074 0.0688 0.0238
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0069 0.0461 0.5
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi G protein-coupled receptor 0.0074 0.0688 0.12
Echinococcus granulosus neuropeptide receptor A26 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi G-protein coupled receptor 0.0074 0.0688 0.12
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Onchocerca volvulus 0.0074 0.0688 0.5
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0177 0.5734 0.5
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.0177 0.5734 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus granulosus serotonin receptor 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus multilocularis neuropeptide receptor A26 0.0074 0.0688 0.0238
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Schistosoma mansoni sterol O-acyltransferase 1 0.0264 1 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0074 0.0688 0.0238
Echinococcus granulosus allatostatin A receptor 0.0074 0.0688 0.0238
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.0177 0.5734 0.5
Echinococcus multilocularis neuropeptide receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) neuropeptide F receptor 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0069 0.0461 0.5
Echinococcus multilocularis orexin receptor type 2 0.0074 0.0688 0.0238
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.0177 0.5734 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis neuropeptide s receptor 0.0074 0.0688 0.0238
Echinococcus granulosus G protein coupled receptor 139 0.0074 0.0688 0.0238
Echinococcus granulosus sex peptide receptor 0.0074 0.0688 0.0238
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0069 0.0461 0.5
Brugia malayi larval opioid receptor 0.0074 0.0688 0.12
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0074 0.0688 0.0238
Echinococcus granulosus tm gpcr rhodopsin 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0177 0.5734 1
Brugia malayi putative neuropeptide receptor 0.0074 0.0688 0.12
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.0177 0.5734 0.5
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus somatostatin receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0074 0.0688 0.0238
Brugia malayi Serotonin receptor 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Plasmodium falciparum dihydroorotate dehydrogenase 0.0177 0.5734 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus granulosus hypothetical protein 0.0074 0.0688 0.0238
Echinococcus granulosus neuropeptide receptor 0.0074 0.0688 0.0238
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.0177 0.5734 0.5
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0074 0.0688 0.0238
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0074 0.0688 0.0238
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Echinococcus granulosus tachykinin peptides receptor 99D 0.0074 0.0688 0.0238
Echinococcus granulosus neuropeptide receptor 0.0074 0.0688 0.0238
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0177 0.5734 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0074 0.0688 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0074 0.0688 0.0238
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Brugia malayi Melatonin receptor type 1A 0.0074 0.0688 0.12
Echinococcus multilocularis G protein coupled receptor 139 0.0074 0.0688 0.0238
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0074 0.0688 0.0238
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.0177 0.5734 1
Echinococcus multilocularis sterol O acyltransferase 1 0.0264 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0074 0.0688 0.0688
Brugia malayi RE15519p 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Brugia malayi AKH receptor 0.0074 0.0688 0.12
Leishmania major dihydroorotate dehydrogenase 0.0177 0.5734 0.5
Echinococcus granulosus g protein coupled receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis neuropeptide receptor 0.0074 0.0688 0.0238
Brugia malayi follicle stimulating hormone receptor 0.0074 0.0688 0.12
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0074 0.0688 0.12
Onchocerca volvulus 0.0074 0.0688 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0074 0.0688 0.0238
Brugia malayi hypothetical protein 0.0074 0.0688 0.12
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Onchocerca volvulus 0.0074 0.0688 0.5
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0069 0.0461 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.0688
Echinococcus multilocularis neuropeptide Y receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis neuropeptide FF receptor 2 0.0074 0.0688 0.0238
Brugia malayi Dopamine receptor protein 1 0.0074 0.0688 0.12
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Echinococcus multilocularis g-protein coupled receptor 0.0074 0.0688 0.0238
Echinococcus multilocularis fmrfamide receptor 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0074 0.0688 0.0238
Echinococcus granulosus tm gpcr rhodopsin 0.0074 0.0688 0.0238
Echinococcus granulosus neuropeptides capa receptor 0.0074 0.0688 0.0238
Echinococcus granulosus neuropeptide s receptor 0.0074 0.0688 0.0238
Echinococcus granulosus peptide allatostatin:somatostatin 0.0074 0.0688 0.0238
Echinococcus multilocularis rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Echinococcus granulosus rhodopsin orphan GPCR 0.0074 0.0688 0.0238
Onchocerca volvulus 0.0074 0.0688 0.5

Activities

Activity type Activity value Assay description Source Reference
Delta HDL (functional) = 240 % Chronic in vivo activity of the compound was measured by the concentration of high density lipoproteins (HDL) in cholesterol fed rats ChEMBL. 8632431
Delta HDL (functional) = 240 % Chronic in vivo activity of the compound was measured by the concentration of high density lipoproteins (HDL) in cholesterol fed rats ChEMBL. 8632431
Delta TC (functional) = -55 % Acute in vivo activity of the compound was measured by the total plasma cholesterol concentration levels(TC) at dose 50 mg/kg ChEMBL. 8632431
Delta TC (functional) = -55 % Acute in vivo activity of the compound was measured by the total plasma cholesterol concentration levels(TC) at dose 50 mg/kg ChEMBL. 8632431
Delta TC (functional) = -33 % Chronic in vivo activity of the compound was measured by the total cholesterol concentration levels in cholesterol fed rats ChEMBL. 8632431
Delta TC (functional) = -33 % Chronic in vivo activity of the compound was measured by the total cholesterol concentration levels in cholesterol fed rats ChEMBL. 8632431
IC50 (binding) = 38.1 uM In vitro inhibitory activity against acyl coenzyme A:cholesterol acyltransferase 1 in microsomes of rat liver ChEMBL. 8632431
IC50 (binding) = 38.1 uM In vitro inhibitory activity against acyl coenzyme A:cholesterol acyltransferase 1 in microsomes of rat liver ChEMBL. 8632431

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

1 literature reference was collected for this gene.

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