Detailed information for compound 824693

Basic information

Technical information
  • TDR Targets ID: 824693
  • Name: N-(4-ethoxyphenyl)-2-[1-(4-methoxyphenyl)-2,5 -dioxo-3-(2-thiophen-2-ylethyl)imidazolidin-4 -yl]acetamide
  • MW: 493.575 | Formula: C26H27N3O5S
  • H donors: 1 H acceptors: 3 LogP: 3.7 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1)NC(=O)CC1N(CCc2cccs2)C(=O)N(C1=O)c1ccc(cc1)OC
  • InChi: 1S/C26H27N3O5S/c1-3-34-21-10-6-18(7-11-21)27-24(30)17-23-25(31)29(19-8-12-20(33-2)13-9-19)26(32)28(23)15-14-22-5-4-16-35-22/h4-13,16,23H,3,14-15,17H2,1-2H3,(H,27,30)
  • InChiKey: AJKPQSIYEFPXAE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-ethoxyphenyl)-2-[1-(4-methoxyphenyl)-2,5-dioxo-3-[2-(2-thienyl)ethyl]imidazolidin-4-yl]acetamide
  • N-(4-ethoxyphenyl)-2-[1-(4-methoxyphenyl)-2,5-dioxo-3-[2-(2-thienyl)ethyl]-4-imidazolidinyl]acetamide
  • 2-[2,5-diketo-1-(4-methoxyphenyl)-3-[2-(2-thienyl)ethyl]imidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide
  • N-(4-ethoxyphenyl)-2-[1-(4-methoxyphenyl)-2,5-dioxo-3-(2-thiophen-2-ylethyl)imidazolidin-4-yl]ethanamide
  • MLS000582515
  • N-(4-ethoxyphenyl)-2-[1-(4-methoxyphenyl)-2,5-dioxo-3-(2-thien-2-ylethyl)imidazolidin-4-yl]acetamide
  • SMR000206501

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0119 0.0793 1
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0083 0.0522 0.0566
Onchocerca volvulus Peroxidase homolog 0.0057 0.0321 0.0323
Schistosoma mansoni ceramide glucosyltransferase 0.1218 0.9228 1
Schistosoma mansoni ceramide glucosyltransferase 0.1218 0.9228 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Brugia malayi CXXC zinc finger family protein 0.0035 0.0148 0.0148
Brugia malayi hypothetical protein 0.0057 0.0321 0.0321
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0111 0.0736 0.9278
Schistosoma mansoni septate junction protein 0.0018 0.0024 0.0026
Brugia malayi Blistered cuticle protein 3 0.0057 0.0321 0.0321
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0083 0.0522 0.0522
Echinococcus multilocularis protein jagged 1 0.0018 0.0024 0.0026
Echinococcus granulosus neurogenic locus protein delta 0.0018 0.0024 0.0026
Toxoplasma gondii target of rapamycin (TOR), putative 0.0025 0.0071 0.1591
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0028 0.0355
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.022 0.1567 0.1699
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0019 0.0028 0.0028
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Echinococcus granulosus ceramide glucosyltransferase 0.1218 0.9228 1
Echinococcus granulosus protein jagged 2 0.0018 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0344 0.0344
Echinococcus granulosus peroxidasin 0.0057 0.0321 0.0348
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0083 0.0518 0.0518
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0034 0.0143 0.0143
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0304 0.3828
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0025 0.0071 0.1023
Trypanosoma brucei glucosidase, putative 0.0034 0.0143 0.6901
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0019 0.0028 0.0031
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0019 0.0028 0.0031
Loa Loa (eye worm) hypothetical protein 0.0034 0.0143 0.0143
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0025 0.0071 0.3408
Onchocerca volvulus Dual oxidase homolog 0.0057 0.0321 0.0323
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0019 0.0028 0.5
Echinococcus multilocularis fibropellin Ia 0.0018 0.0024 0.0026
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0445 0.5
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Onchocerca volvulus Peroxidasin homolog 0.0057 0.0321 0.0323
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0101 0.0657 0.0657
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Loa Loa (eye worm) animal heme peroxidase 0.0057 0.0321 0.0321
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0025 0.0071 0.0071
Echinococcus granulosus neurogenic locus notch protein 0.0018 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0042 0.0208 0.262
Echinococcus multilocularis protein jagged 2 0.0018 0.0024 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0025 0.0071 0.0893
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Echinococcus multilocularis neural cadherin 0.0018 0.0024 0.0026
Echinococcus granulosus protein jagged 1 0.0018 0.0024 0.0026
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0025 0.0071 0.1023
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0445 0.0482
Trichomonas vaginalis glucosylceramidase, putative 0.0912 0.6878 0.6878
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0034 0.0143 0.1808
Onchocerca volvulus 0.0238 0.1709 0.1831
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0078 0.0483 0.0524
Echinococcus multilocularis bile acid beta glucosidase 0.1063 0.8037 0.8709
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0042 0.0208 0.0208
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Echinococcus multilocularis protein jagged 1 0.0018 0.0024 0.0026
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Brugia malayi Animal haem peroxidase family protein 0.0057 0.0321 0.0321
Echinococcus multilocularis neurogenic locus notch protein 0.0018 0.0024 0.0026
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0025 0.0071 0.0077
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Echinococcus granulosus microtubule associated protein 2 0.0833 0.6275 0.68
Brugia malayi Calcium binding EGF domain containing protein 0.0018 0.0024 0.0024
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0344 0.0344
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0019 0.0028 0.0028
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0445 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0042 0.0208 0.262
Echinococcus multilocularis slit 2 protein 0.0018 0.0024 0.0026
Brugia malayi Animal haem peroxidase family protein 0.0057 0.0321 0.0321
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Leishmania major alpha glucosidase II subunit, putative 0.0034 0.0143 0.2765
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0025 0.0071 0.0893
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0042 0.0208 0.262
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0029 0.0031
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0019 0.0028 0.0028
Trichomonas vaginalis PIKK family atypical protein kinase 0.0037 0.0167 0.0167
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0018 0.0024 0.0024
Schistosoma mansoni bile acid beta-glucosidase-related 0.1063 0.8037 0.8709
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0354 0.2601 0.2601
Loa Loa (eye worm) hypothetical protein 0.0041 0.0198 0.0198
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Leishmania major glycosyl hydrolase-like protein 0.0034 0.0143 0.2765
Trichomonas vaginalis maltase-glucoamylase, putative 0.0034 0.0143 0.0143
Echinococcus granulosus neurogenic locus notch protein 0.0018 0.0024 0.0026
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0034 0.0143 0.0143
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0017 0.001 0.0235
Schistosoma mansoni hypothetical protein 0.0019 0.0029 0.0031
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0059 0.0338 0.0766
Onchocerca volvulus Glucosylceramidase homolog 0.0865 0.6521 0.7059
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0083 0.0518 0.0518
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Schistosoma mansoni bile acid beta-glucosidase-related 0.1063 0.8037 0.8709
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) hypothetical protein 0.006 0.0344 0.0344
Brugia malayi Glycosyl hydrolases family 31 protein 0.0034 0.0143 0.0143
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0019 0.0028 0.0355
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0019 0.0028 0.0028
Schistosoma mansoni hypothetical protein 0.0205 0.1452 0.1574
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0034 0.0143 0.1808
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0019 0.0028 0.0031
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0095 0.0613 0.7735
Echinococcus granulosus delta-like protein 1 0.0018 0.0024 0.0026
Brugia malayi Animal haem peroxidase family protein 0.0057 0.0321 0.0321
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.022 0.1567 0.1699
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0386 0.8686
Loa Loa (eye worm) animal heme peroxidase 0.0057 0.0321 0.0321
Trichomonas vaginalis PIKK family atypical protein kinase 0.0028 0.0096 0.0096
Schistosoma mansoni hypothetical protein 0.0494 0.3672 0.3979
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0445 1
Echinococcus granulosus protein jagged 1 0.0018 0.0024 0.0026
Echinococcus granulosus neurogenic locus notch protein 4 0.0018 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Brugia malayi Calcium binding EGF domain containing protein 0.0018 0.0024 0.0024
Brugia malayi Ceramide glucosyltransferase 0.1218 0.9228 0.9228
Loa Loa (eye worm) animal heme peroxidase 0.0057 0.0321 0.0321
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0018 0.0024 0.0026
Echinococcus granulosus fibropellin Ia 0.0018 0.0024 0.0026
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0034 0.0143 0.1808
Loa Loa (eye worm) Notch2 0.0018 0.0024 0.0024
Echinococcus multilocularis cpg binding protein 0.0037 0.0164 0.0177
Echinococcus multilocularis lysosomal alpha glucosidase 0.0354 0.2601 0.2818
Brugia malayi GCC2 and GCC3 family protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) notch protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Echinococcus granulosus neural cadherin 0.0018 0.0024 0.0026
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Trichomonas vaginalis glucosylceramidase, putative 0.0912 0.6878 0.6878
Onchocerca volvulus Peroxidase homolog 0.0057 0.0321 0.0323
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0029 0.0029
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Schistosoma mansoni alpha glucosidase 0.0034 0.0143 0.0155
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0029 0.0031
Leishmania major phosphatidylinositol 3-kinase, putative 0.0025 0.0071 0.1023
Loa Loa (eye worm) hypothetical protein 0.0718 0.5387 0.5387
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0019 0.0028 0.5
Echinococcus granulosus protein jagged 2 0.0018 0.0024 0.0026
Echinococcus multilocularis ceramide glucosyltransferase 0.1218 0.9228 1
Schistosoma mansoni cell polarity protein 0.0018 0.0024 0.0026
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0035 0.015 0.1898
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Echinococcus multilocularis non lysosomal glucosylceramidase 0.1063 0.8037 0.8709
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0034 0.0143 0.1808
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Echinococcus multilocularis neurogenic locus notch protein 0.0018 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Brugia malayi Muscle positioning protein 4 0.0018 0.0024 0.0024
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0029 0.0029
Echinococcus multilocularis GPCR, family 2 0.0019 0.0029 0.0031
Loa Loa (eye worm) blistered cuticle protein 3 0.0057 0.0321 0.0321
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Schistosoma mansoni laminin gamma-3 chain 0.0018 0.0024 0.0026
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0445 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) phosphatidylinositol 3 0.0035 0.015 0.015
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0034 0.0143 0.0143
Toxoplasma gondii EGF family domain-containing protein 0.0018 0.0024 0.0542
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Echinococcus multilocularis notch 0.0018 0.0024 0.0026
Echinococcus multilocularis Zinc finger, PHD finger 0.0019 0.0028 0.0031
Schistosoma mansoni hypothetical protein 0.0019 0.0029 0.0031
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0119 0.0793 1
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0017 0.001 0.0504
Echinococcus granulosus GPCR family 2 0.0019 0.0029 0.0031
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0042 0.0208 0.0208
Onchocerca volvulus 0.0035 0.0148 0.0135
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0445 1
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Loa Loa (eye worm) hypothetical protein 0.0019 0.0029 0.0029
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0034 0.0143 0.3223
Echinococcus granulosus geminin 0.0205 0.1452 0.1574
Schistosoma mansoni alpha-glucosidase 0.0354 0.2601 0.2818
Brugia malayi Animal haem peroxidase family protein 0.0057 0.0321 0.0321
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Trypanosoma brucei glycosyl hydrolase-like protein 0.0034 0.0143 0.6901
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0119 0.0793 0.0793
Schistosoma mansoni hypothetical protein 0.0019 0.0029 0.0031
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Echinococcus granulosus cpg binding protein 0.0037 0.0164 0.0177
Brugia malayi Calcium binding EGF domain containing protein 0.0018 0.0024 0.0024
Onchocerca volvulus 0.0057 0.0321 0.0323
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0148 0.0148
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0042 0.0208 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0042 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Loa Loa (eye worm) animal heme peroxidase 0.0057 0.0321 0.0321
Onchocerca volvulus 0.0057 0.0321 0.0323
Schistosoma mansoni hypothetical protein 0.0019 0.0029 0.0031
Loa Loa (eye worm) phosphatidylinositol 3 0.0196 0.1388 0.1388
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0028 0.1356
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0034 0.0143 0.1808
Trypanosoma cruzi target of rapamycin kinase 3 0.0025 0.0071 0.0893
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0119 0.0793 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trichomonas vaginalis sucrase-isomaltase, putative 0.0034 0.0143 0.0143
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0029 0.0031
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.3672 0.3979
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.0028 0.0096 0.1215
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0119 0.0793 0.0793
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0019 0.0028 0.0633
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0445 0.0482
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0025 0.0071 0.0893
Echinococcus granulosus notch 0.0018 0.0024 0.0026
Echinococcus multilocularis lysosomal alpha glucosidase 0.0354 0.2601 0.2818
Schistosoma mansoni slit 0.0018 0.0024 0.0026
Onchocerca volvulus Chorion peroxidase homolog 0.0057 0.0321 0.0323
Echinococcus granulosus dnaJ subfamily B 0.0494 0.3672 0.3979
Schistosoma mansoni hypothetical protein 0.0041 0.0198 0.0215
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0029 0.0029
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0042 0.0208 0.0208
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0019 0.0028 0.0031
Trichomonas vaginalis conserved hypothetical protein 0.0017 0.001 0.001
Brugia malayi Cadherin domain containing protein 0.0018 0.0024 0.0024
Brugia malayi notch-like transmembrane receptor 0.0018 0.0024 0.0024
Echinococcus granulosus lysosomal alpha glucosidase 0.0354 0.2601 0.2818
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0037 0.0167 0.3335
Entamoeba histolytica hypothetical protein 0.0095 0.0613 0.7735
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0445 0.0482
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0445 0.5
Echinococcus granulosus non lysosomal glucosylceramidase 0.1063 0.8037 0.8709
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Trypanosoma cruzi hypothetical protein, conserved 0.0034 0.0143 0.1808
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0119 0.0793 0.0793
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0445 0.0482
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Schistosoma mansoni cpg binding protein 0.0037 0.0164 0.0177
Schistosoma mansoni cpg binding protein 0.0037 0.0164 0.0177
Trypanosoma cruzi hypothetical protein, conserved 0.0034 0.0143 0.1808
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0025 0.0071 0.3408
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.6275 0.68
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) ceramide glucosyltransferase 0.1218 0.9228 0.9228
Echinococcus multilocularis geminin 0.0205 0.1452 0.1574
Loa Loa (eye worm) hypothetical protein 0.004 0.0192 0.0192
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.1319 1 1
Echinococcus multilocularis neurogenic locus protein delta 0.0018 0.0024 0.0026
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.022 0.1567 0.1699
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0025 0.0071 0.3408
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0034 0.0143 0.0143
Onchocerca volvulus Peroxidasin homolog 0.0057 0.0321 0.0323
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Echinococcus multilocularis peroxidasin 0.0057 0.0321 0.0348
Loa Loa (eye worm) hypothetical protein 0.0057 0.0321 0.0321
Schistosoma mansoni hypothetical protein 0.0205 0.1452 0.1574
Echinococcus multilocularis neutral alpha glucosidase AB 0.0034 0.0143 0.0155
Schistosoma mansoni cpg binding protein 0.0035 0.0148 0.0161
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.6275 0.68
Trichomonas vaginalis PIKK family atypical protein kinase 0.0017 0.001 0.001
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0025 0.0071 0.0077
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Onchocerca volvulus 0.0057 0.0321 0.0323
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0078 0.0483 0.0483
Trichomonas vaginalis maltase-glucoamylase, putative 0.0034 0.0143 0.0143
Echinococcus multilocularis neurogenic locus notch protein 4 0.0018 0.0024 0.0026
Giardia lamblia GTOR 0.0025 0.0071 0.0114
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Schistosoma mansoni peroxidasin 0.0057 0.0321 0.0348
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0019 0.0028 0.0028
Loa Loa (eye worm) phosphatidylinositol 3 0.0037 0.0167 0.0167
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0034 0.0143 0.013
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0447 0.0484
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0034 0.0143 0.0143
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0083 0.0522 0.6588
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0025 0.0071 0.0893
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0025 0.0071 0.3408
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Loa Loa (eye worm) phosphatidylinositol 3 0.0025 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0017 0.001 0.001
Schistosoma mansoni alpha-glucosidase 0.0354 0.2601 0.2818
Echinococcus multilocularis neurogenic locus protein delta 0.0018 0.0024 0.0026
Schistosoma mansoni peroxidasin 0.0057 0.0321 0.0348
Brugia malayi Cadherin domain containing protein 0.0018 0.0024 0.0024
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.1218 0.9228 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0031 0.0119 0.0232
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0119 0.0793 0.0793
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Loa Loa (eye worm) hypothetical protein 0.0078 0.0483 0.0483
Brugia malayi Animal haem peroxidase family protein 0.0057 0.0321 0.0321
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0025 0.0071 0.0077
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0083 0.0522 0.0566
Echinococcus granulosus bile acid beta glucosidase 0.1063 0.8037 0.8709
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Brugia malayi Delta serrate ligand family protein 0.0018 0.0024 0.0024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0019 0.0028 0.0031
Brugia malayi Peroxidasin 0.0057 0.0321 0.0321
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0028 0.0355
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Schistosoma mansoni notch 0.0018 0.0024 0.0026
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0078 0.0483 0.0524
Trichomonas vaginalis glucosylceramidase, putative 0.0865 0.6521 0.6521
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0019 0.0028 0.0633
Giardia lamblia Ceramide glucosyltransferase 0.0552 0.4119 1
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0037 0.0167 0.8045
Brugia malayi Glycosyl hydrolases family 31 protein 0.0354 0.2601 0.2601
Echinococcus granulosus neutral alpha glucosidase AB 0.0034 0.0143 0.0155
Brugia malayi Glycosyl hydrolases family 31 protein 0.0034 0.0143 0.0143
Schistosoma mansoni hypothetical protein 0.0018 0.0024 0.0026
Trichomonas vaginalis alpha-glucosidase, putative 0.0034 0.0143 0.0143
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0198 0.0198
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0019 0.0028 0.0355
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0029 0.0031
Echinococcus multilocularis fat cadherin tumor suppressor 0.0018 0.0024 0.0026
Echinococcus granulosus slit 2 protein 0.0018 0.0024 0.0026
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0083 0.0522 0.0566
Trichomonas vaginalis glucosylceramidase, putative 0.1319 1 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0042 0.0208 0.0225
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0071 0.0071
Brugia malayi EGF-like domain containing protein 0.0018 0.0024 0.0024
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0083 0.0522 0.6588
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0025 0.0071 0.1023

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.8526 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) 2.3109 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.3078 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) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.929 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1). (Class of assay: confirmatory) [Related pubchem assays: 594 (Rhodamine region spectral profiling screen), 593 (Fluorescein region spectral profiling screen), 2367 (Probe Development Summary for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1)), 2353 (qHTS Validation Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1))] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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