Detailed information for compound 1612754

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 542.558 | Formula: C26H26N2O9S
  • H donors: 4 H acceptors: 7 LogP: 2.08 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1cc(OC)c(cc1S(=O)(=O)NCc1ccccc1c1ccc(cc1)C(=O)O)NC(=O)CCC(=O)O
  • InChi: 1S/C26H26N2O9S/c1-36-21-14-22(37-2)23(13-20(21)28-24(29)11-12-25(30)31)38(34,35)27-15-18-5-3-4-6-19(18)16-7-9-17(10-8-16)26(32)33/h3-10,13-14,27H,11-12,15H2,1-2H3,(H,28,29)(H,30,31)(H,32,33)
  • InChiKey: ZJOBJQWOISSDKX-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli fused N-acetyl glucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyl transferase Starlite/ChEMBL References
Streptococcus pneumoniae serotype 4 (strain ATCC BAA-334 / TIGR4) Bifunctional protein GlmU Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium leprae Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU Get druggable targets OG5_131193 All targets in OG5_131193
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase Get druggable targets OG5_131193 All targets in OG5_131193
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU Get druggable targets OG5_131193 All targets in OG5_131193
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase Get druggable targets OG5_131193 All targets in OG5_131193

By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0023 0.0072 0.0042
Schistosoma mansoni biogenic amine receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0023 0.0072 0.0053
Schistosoma mansoni amine GPCR 0.0023 0.0072 0.0209
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Echinococcus multilocularis neuropeptide FF receptor 2 0.0023 0.0072 0.0042
Schistosoma mansoni biogenic amine (5HT) receptor 0.0023 0.0072 0.0209
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0072 0.0042
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Echinococcus granulosus neuropeptide Y receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis somatostatin receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis G protein coupled receptor 139 0.0435 0.3425 1
Schistosoma mansoni biogenic amine receptor 0.0023 0.0072 0.0209
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni neuropeptide receptor 0.0023 0.0072 0.0209
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0072 0.0209
Brugia malayi RE15519p 0.0023 0.0072 0.0053
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni hypothetical protein 0.0023 0.0072 0.0209
Echinococcus granulosus biogenic amine 5HT receptor 0.0023 0.0072 0.0042
Brugia malayi Dopamine receptor protein 1 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase 0.1243 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi GnHR receptor homolog 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni nephrin 0.0027 0.0102 0.0298
Schistosoma mansoni cell adhesion molecule 0.0028 0.0114 0.0334
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi sulfakinin receptor protein 0.0023 0.0072 0.0053
Brugia malayi putative neuropeptide receptor 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptide receptor 0.0023 0.0072 0.0042
Schistosoma mansoni hypothetical protein 0.0023 0.0072 0.0209
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis serotonin receptor 0.0023 0.0072 0.0042
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Echinococcus multilocularis allatostatin A receptor 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni neuropeptide receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) G-protein coupled receptor 0.0023 0.0072 0.0053
Schistosoma mansoni vesicular amine transporter 0.0021 0.0057 0.0167
Echinococcus multilocularis fmrfamide receptor 0.0023 0.0072 0.0042
Brugia malayi Dopamine receptor 0.0023 0.0072 0.0053
Echinococcus multilocularis neuropeptides capa receptor 0.0023 0.0072 0.0042
Echinococcus granulosus G protein coupled receptor 139 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Schistosoma mansoni neuropeptide F-like receptor 0.0023 0.0072 0.0209
Schistosoma mansoni amine GPCR 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis neuropeptide s receptor 0.0023 0.0072 0.0042
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi putative neuropeptide receptor NPR1 0.0023 0.0072 0.0053
Schistosoma mansoni opsin-like receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0023 0.0072 0.0042
Echinococcus multilocularis neuropeptide Y receptor 0.0023 0.0072 0.0042
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0023 0.0072 0.0209
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Schistosoma mansoni neuropeptide receptor 0.0435 0.3425 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Echinococcus granulosus peptide allatostatin:somatostatin 0.0023 0.0072 0.0042
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0023 0.0072 0.0042
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) melatonin receptor type 1A 0.0023 0.0072 0.0053
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0023 0.0072 0.0042
Echinococcus granulosus g protein coupled receptor 0.0023 0.0072 0.0042
Echinococcus granulosus 7tm_1 domain containing protein 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus roundabout 2 0.0034 0.0159 0.0302
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi larval opioid receptor 0.0023 0.0072 0.0053
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0072 0.0042
Echinococcus granulosus fmrfamide receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi G protein-coupled receptor 0.0023 0.0072 0.0053
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0023 0.0072 0.0053
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Toxoplasma gondii eukaryotic initiation factor-2B, gamma subunit, putative 0.0125 0.0904 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0023 0.0072 0.0042
Echinococcus granulosus neuroglian 0.0027 0.0102 0.0133
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Brugia malayi neuropeptide F receptor 0.0023 0.0072 0.0053
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Loa Loa (eye worm) G-protein coupled receptor 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi Serotonin receptor 0.0023 0.0072 0.0053
Schistosoma mansoni adenoreceptor 0.0023 0.0072 0.0209
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis neuropeptide receptor A26 0.0023 0.0072 0.0042
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0034 0.0159 0.0381
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0028 0.0114 0.0169
Echinococcus granulosus dro:myosuppressin receptor 0.0023 0.0072 0.0042
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Brugia malayi G-protein coupled receptor 0.0023 0.0072 0.0053
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0072 0.0042
Schistosoma mansoni myosin xvIII 0.0023 0.0072 0.0209
Echinococcus multilocularis sex peptide receptor 0.0023 0.0072 0.0042
Echinococcus granulosus alpha 1A adrenergic receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0072 0.0042
Echinococcus granulosus 7TM GPCR rhodopsin 0.0023 0.0072 0.0042
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0072 0.0042
Echinococcus granulosus neuropeptide receptor A26 0.0023 0.0072 0.0042
Echinococcus multilocularis serotonin receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni neuropeptide f receptor 76f 0.0023 0.0072 0.0209
Brugia malayi Dopamine receptor protein 2 0.0023 0.0072 0.0053
Schistosoma mansoni biogenic amine receptor 0.0023 0.0072 0.0209
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0028 0.0114 0.0214
Echinococcus multilocularis G-protein coupled receptor, putative 0.0023 0.0072 0.0042
Schistosoma mansoni alpha-1 adrenergic receptor 0.0023 0.0072 0.0209
Brugia malayi Serotonin receptor 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis neuropeptides capa receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis dro:myosuppressin receptor 0.0023 0.0072 0.0042
Echinococcus granulosus orexin receptor type 2 0.0023 0.0072 0.0042
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0021 0.0057 0.0167
Schistosoma mansoni histamine h1 receptor 0.0023 0.0072 0.0209
Schistosoma mansoni opsin-like receptor 0.0023 0.0072 0.0209
Brugia malayi Immunoglobulin I-set domain containing protein 0.0349 0.2724 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0159 0.0381
Echinococcus granulosus g protein coupled receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis g-protein coupled receptor 0.0023 0.0072 0.0042
Brugia malayi neuropeptide F receptor 0.0023 0.0072 0.0053
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0072 0.0209
Brugia malayi Melatonin receptor type 1A 0.0023 0.0072 0.0053
Echinococcus granulosus tm gpcr rhodopsin 0.0023 0.0072 0.0042
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Treponema pallidum licC protein (licC) 0.0125 0.0904 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0023 0.0072 0.0042
Echinococcus granulosus allatostatin A receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0023 0.0072 0.0042
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 0.1243 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0023 0.0072 0.0053
Schistosoma mansoni amine GPCR 0.0023 0.0072 0.0209
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0023 0.0072 0.0042
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis fmrfamide receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis neuropeptide receptor 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0023 0.0072 0.0209
Schistosoma mansoni amine GPCR 0.0023 0.0072 0.0209
Schistosoma mansoni growth hormone secretagogue receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0023 0.0072 0.0209
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni neuropeptide receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0023 0.0072 0.0053
Brugia malayi G-protein coupled receptor 0.0023 0.0072 0.0053
Brugia malayi G protein-coupled receptor F59B2.13 0.0023 0.0072 0.0053
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Echinococcus multilocularis neuropeptide Y receptor 0.0023 0.0072 0.0042
Echinococcus granulosus sex peptide receptor 0.0023 0.0072 0.0042
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Onchocerca volvulus Tyrosine kinase homolog 0.0326 0.2537 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0023 0.0072 0.0042
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus tachykinin peptides receptor 99D 0.0023 0.0072 0.0042
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0023 0.0072 0.0042
Brugia malayi ORL1-like opioid receptor 0.0023 0.0072 0.0053
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni hypothetical protein 0.0023 0.0072 0.0209
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0023 0.0072 0.0209
Brugia malayi AKH receptor 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) neuropeptide F receptor 0.0023 0.0072 0.0053
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.1243 1 1
Echinococcus granulosus serotonin receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0023 0.0072 0.0042
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Schistosoma mansoni opsin-like receptor 0.0023 0.0072 0.0209
Echinococcus granulosus biogenic amine 5HT receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0023 0.0072 0.0042
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0023 0.0072 0.0209
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptides capa receptor 0.0023 0.0072 0.0042
Brugia malayi follicle stimulating hormone receptor 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptide FF receptor 2 0.0023 0.0072 0.0042
Echinococcus granulosus somatostatin receptor 0.0023 0.0072 0.0042
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptides capa receptor 0.0023 0.0072 0.0042
Echinococcus granulosus g-protein coupled receptor 0.0023 0.0072 0.0042
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0023 0.0072 0.0042
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptide s receptor 0.0023 0.0072 0.0042
Brugia malayi Tachykinin-like peptides receptor 99D 0.0023 0.0072 0.0053
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Echinococcus multilocularis roundabout 2 0.0034 0.0159 0.0302
Brugia malayi hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni neuropeptide F-like receptor 0.0023 0.0072 0.0209
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0023 0.0072 0.0053
Loa Loa (eye worm) TYRA-2 protein 0.0023 0.0072 0.0053
Echinococcus multilocularis orexin receptor type 2 0.0023 0.0072 0.0042
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) neuropeptide F receptor 0.0023 0.0072 0.0053
Echinococcus multilocularis neuroglian 0.0027 0.0102 0.0133
Echinococcus multilocularis rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Echinococcus multilocularis g protein coupled receptor 0.0023 0.0072 0.0042
Echinococcus granulosus neuropeptide receptor 0.0435 0.3425 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni amine GPCR 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0023 0.0072 0.0209
Echinococcus granulosus twitchin 0.0027 0.0102 0.0133
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0349 0.2724 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0021 0.0057 0.0167
Echinococcus granulosus rhodopsin orphan GPCR 0.0023 0.0072 0.0042
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0023 0.0072 0.0209
Echinococcus multilocularis neuropeptide receptor 0.0435 0.3425 1
Echinococcus granulosus g protein coupled receptor 0.0023 0.0072 0.0042
Onchocerca volvulus 0.0319 0.2477 0.9754
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0023 0.0072 0.0209
Loa Loa (eye worm) hypothetical protein 0.0023 0.0072 0.0053
Echinococcus granulosus neuropeptide Y receptor 0.0023 0.0072 0.0042
Echinococcus granulosus hypothetical protein 0.0023 0.0072 0.0042
Schistosoma mansoni hypothetical protein 0.0023 0.0072 0.0209

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 6.046 Inhibition of Escherichia coli GlmU acetyltransferase activity assessed as coenzyme A production using acetyl CoA substrate ChEMBL. 25544688
IC50 (binding) = 0.9 uM Inhibition of Escherichia coli GlmU acetyltransferase activity assessed as coenzyme A production using acetyl CoA substrate ChEMBL. 25544688
IC50 (binding) = 15 uM Inhibition of Streptococcus pneumoniae acetyltransferase activity of GlmU using acetyl-CoA and glucosamine-1-phosphate after 30 mins by Ellman's method ChEMBL. 22297115

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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