Detailed information for compound 1212197

Basic information

Technical information
  • TDR Targets ID: 1212197
  • Name: 1-(4-hydroxy-1,1-dioxothiolan-3-yl)-3-phenylu rea
  • MW: 270.305 | Formula: C11H14N2O4S
  • H donors: 3 H acceptors: 4 LogP: -0.48 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1)NC1CS(=O)(=O)CC1O
  • InChi: 1S/C11H14N2O4S/c14-10-7-18(16,17)6-9(10)13-11(15)12-8-4-2-1-3-5-8/h1-5,9-10,14H,6-7H2,(H2,12,13,15)
  • InChiKey: OJCUILNGXCCKAX-UHFFFAOYSA-N  

Network

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Synonyms

  • 1-(4-hydroxy-1,1-dioxo-thiolan-3-yl)-3-phenyl-urea
  • 1-(4-hydroxy-1,1-dioxo-3-thiolanyl)-3-phenylurea
  • 1-(4-hydroxy-1,1-diketo-thiolan-3-yl)-3-phenyl-urea
  • MLS000058796
  • N-(4-hydroxy-1,1-dioxidotetrahydro-3-thienyl)-N'-phenylurea
  • SMR000069062
  • Oprea1_590342
  • 1-(4-Hydroxy-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-yl)-3-phenyl-urea
  • BAS 05437783
  • STOCK1S-38200

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens glucosidase, alpha Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) glycosyl hydrolase family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Glycosyl hydrolases family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Lysosomal alpha-glucosidase precursor, putative Get druggable targets OG5_127055 All targets in OG5_127055
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K01187 alpha-glucosidase [EC3.2.1.20], putative Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Onchocerca volvulus Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0016 0.0019 0.0041
Brugia malayi Glycosyl hydrolases family 31 protein 0.0016 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0205 0.0512 0.0512
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0025 0.0204
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0069 0.0156 0.0729
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0042 0.4421
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.014 0.0342 0.1019
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0114 0.0273 0.0273
Echinococcus multilocularis baculoviral IAP repeat containing protein 0.0106 0.0253 0.1184
Schistosoma mansoni neprilysin-2 (M13 family) 0.014 0.0342 0.1019
Onchocerca volvulus 0.003 0.0054 0.0254
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0268 0.0678 0.0678
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0168 0.2289
Schistosoma mansoni hypothetical protein 0.0345 0.0878 0.2643
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0025 0.0089
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0138 0.04
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Echinococcus granulosus intermediate filament protein 0.0028 0.0049 0.0176
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0015 0.0015
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0124 0.0299 0.0299
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0304 0.0771 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.0293 0.0293
Echinococcus granulosus geminin 0.0345 0.0878 0.3146
Entamoeba histolytica acetyltransferase, GNAT family 0.0041 0.0082 0.0956
Loa Loa (eye worm) hypothetical protein 0.0025 0.0041 0.004
Loa Loa (eye worm) zinc metallopeptidase 4 0.0068 0.0153 0.0153
Echinococcus multilocularis ephrin type A receptor 4 A 0.0065 0.0145 0.068
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0016 0.0019 0.0119
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.0092 0.1083
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0041 0.0407
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.0092 0.0329
Loa Loa (eye worm) acetyltransferase 0.0151 0.037 0.037
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0025 0.0204
Echinococcus granulosus GPCR family 2 0.0016 0.0019 0.0067
Brugia malayi Phospholipase A2 family protein 0.0683 0.1762 0.1762
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.1273 0.3307 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0019 0.0019
Loa Loa (eye worm) integrin alpha pat-2 0.0231 0.0582 0.0581
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0112 0.0111
Echinococcus granulosus tar DNA binding protein 0.0062 0.0138 0.0492
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0195 0.0487 0.2284
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0195 0.0487 0.1458
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0042 0.2203
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0041 0.0041
Schistosoma mansoni cpg binding protein 0.003 0.0054 0.0147
Brugia malayi hypothetical protein 0.0013 0.001 0.001
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0006 0.0025
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0197 0.0491 0.0491
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.0092 0.1083
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0012 0.0053
Brugia malayi Integrin alpha pat-2 precursor 0.015 0.0369 0.0369
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Brugia malayi TATA binding protein associated factor 0.0013 0.001 0.001
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0024 0.0212
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 0.0277 0.0701 1
Echinococcus multilocularis neuropeptide s receptor 0.048 0.1233 0.5786
Leishmania major alpha glucosidase II subunit, putative 0.0044 0.009 0.5099
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.0491 0.2303
Schistosoma mansoni inhibitor of apoptosis protein 0.0106 0.0253 0.0748
Mycobacterium ulcerans epoxide hydrolase EphA 0.0167 0.0412 0.5815
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0124 0.0299 0.1404
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0072 0.0165 0.0484
Schistosoma mansoni alpha-glucosidase 0.0169 0.0419 0.1253
Loa Loa (eye worm) hypothetical protein 0.0013 0.001 0.001
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0041 0.0448
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0042 0.2203
Loa Loa (eye worm) hypothetical protein 0.0205 0.0512 0.0512
Mycobacterium leprae probable zinc metalloprotease 0.0277 0.0701 1
Schistosoma mansoni hypothetical protein 0.0016 0.0019 0.0041
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.0092 0.1191
Echinococcus granulosus Solute carrier family 22 5 0.1076 0.279 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0041 0.0448
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0016 0.0019 0.0119
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0013 0.001 0.0044
Entamoeba histolytica acyl-coA synthetase, putative 0.0025 0.0041 0.0407
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.009 0.1061
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0277 0.0701 0.2108
Loa Loa (eye worm) hypothetical protein 0.0013 0.001 0.0009
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0041 0.0448
Onchocerca volvulus 0.0028 0.0049 0.0227
Loa Loa (eye worm) hypothetical protein 0.0025 0.0042 0.0041
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0167 0.0412 0.574
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0006 0.0019
Trichomonas vaginalis sucrase-isomaltase, putative 0.0044 0.009 0.1061
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0044 0.009 0.1167
Schistosoma mansoni ap endonuclease 0.0019 0.0025 0.0059
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0019 0.0119
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.009 0.1061
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0151 0.037 0.1736
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0025 0.1881
Loa Loa (eye worm) hypothetical protein 0.0083 0.0193 0.0193
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0041 0.1956
Loa Loa (eye worm) hypothetical protein 0.0277 0.0701 0.0701
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.0092 0.1191
Schistosoma mansoni hypothetical protein 0.0016 0.0019 0.0041
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Echinococcus granulosus neuropeptide receptor A26 0.048 0.1233 0.4418
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Onchocerca volvulus 0.0028 0.0049 0.0227
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0049 0.0049
Loa Loa (eye worm) RNA binding protein 0.0062 0.0138 0.0137
Loa Loa (eye worm) hypothetical protein 0.0035 0.0068 0.0068
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0025 0.1062
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0041 0.0041
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0138 0.0138
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.014 0.0342 0.1019
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0041 0.0448
Loa Loa (eye worm) hypothetical protein 0.0106 0.0253 0.0252
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.009 0.1061
Leishmania major glycosyl hydrolase-like protein 0.0016 0.0019 0.0573
Loa Loa (eye worm) TK/EPH protein kinase 0.0082 0.0191 0.0191
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0013 0.001 0.0044
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.009 0.1061
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0035 0.0069 0.0068
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0168 0.2152
Loa Loa (eye worm) hypothetical protein 0.0052 0.0112 0.0111
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0025 0.0204
Loa Loa (eye worm) hypothetical protein 0.0025 0.0041 0.004
Echinococcus granulosus leukotriene A 4 hydrolase 0.0124 0.0299 0.1072
Brugia malayi ephrin receptor 1 precursor 0.0031 0.0057 0.0057
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0049 0.0049
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Schistosoma mansoni inhibitor of apoptosis (iap) domain family member 0.0106 0.0253 0.0748
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.014 0.0342 0.1019
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0013 0.001 0.0012
Loa Loa (eye worm) hypothetical protein 0.0016 0.0019 0.0019
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.009 0.1061
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0156 1
Trichomonas vaginalis maltase-glucoamylase, putative 0.0044 0.009 0.1061
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.3831 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0013 0.001 0.0044
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0138 0.04
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0106 0.0253 0.0253
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0138 0.0137
Echinococcus granulosus inhibitor of apoptosis protein 0.0106 0.0253 0.0904
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0195 0.0487 0.2284
Echinococcus multilocularis inhibitor of apoptosis protein 0.0106 0.0253 0.1184
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0012 0.004
Brugia malayi Peptidase family M1 containing protein 0.0013 0.001 0.001
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Onchocerca volvulus 0.0137 0.0335 0.1859
Brugia malayi Peptidase family M13 containing protein 0.0277 0.0701 0.0701
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0138 0.0644
Onchocerca volvulus 0.0064 0.0143 0.0763
Brugia malayi hypothetical protein 0.0111 0.0266 0.0266
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0041 0.0448
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0142 0.0412
Schistosoma mansoni ap endonuclease 0.0019 0.0025 0.0059
Echinococcus multilocularis transcription factor Dp 1 0.004 0.008 0.0374
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0273 0.0691 0.0691
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.009 0.1061
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.0461 0.5937
Echinococcus granulosus aminopeptidase N 0.0013 0.001 0.0033
Brugia malayi peptidase family M13 containing protein 0.0068 0.0153 0.0153
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0013 0.001 0.0012
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0112 0.0112
Echinococcus granulosus integrin alpha ps 0.0067 0.0152 0.0545
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0148 0.0364 0.4898
Treponema pallidum fructose-bisphosphate aldolase 0.0304 0.0771 1
Echinococcus multilocularis neuropeptide receptor A26 0.048 0.1233 0.5786
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0151 0.037 0.1104
Brugia malayi acetyltransferase, GNAT family protein 0.0151 0.037 0.037
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0041 0.0278
Schistosoma mansoni neprilysin 0.0072 0.0165 0.0484
Schistosoma mansoni cpg binding protein 0.0032 0.0059 0.0161
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0024 0.5
Schistosoma mansoni integrin alpha-ps 0.0035 0.0068 0.0189
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0044 0.009 0.009
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0138 0.04
Echinococcus multilocularis integrin alpha ps 0.0032 0.0061 0.0283
Echinococcus multilocularis neutral alpha glucosidase AB 0.0044 0.009 0.0423
Loa Loa (eye worm) hypothetical protein 0.0205 0.0512 0.0512
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Schistosoma mansoni endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase) 0.0068 0.0153 0.0446
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0019 0.0019
Onchocerca volvulus Phospholipase A2 homolog 0.0273 0.0691 0.389
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0195 0.0487 0.1458
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0168 0.0601
Schistosoma mansoni hypothetical protein 0.0032 0.0061 0.0167
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0195 0.0487 0.1458
Schistosoma mansoni ephrin receptor 0.0065 0.0145 0.0423
Brugia malayi MH2 domain containing protein 0.0121 0.0293 0.0293
Echinococcus granulosus transcription factor Dp 1 0.004 0.008 0.0286
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0069 0.0069
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0069 0.0156 0.9218
Schistosoma mansoni integrin alpha-ps 0.0067 0.0152 0.0444
Loa Loa (eye worm) hypothetical protein 0.0016 0.0019 0.0018
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0138 0.04
Schistosoma mansoni Nep2 peptidase (M13 family) 0.014 0.0342 0.1019
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0069 0.0156 0.0155
Loa Loa (eye worm) hypothetical protein 0.0033 0.0061 0.0061
Schistosoma mansoni lamin 0.0028 0.0049 0.0133
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0025 0.0025
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0112 0.0112
Loa Loa (eye worm) hypothetical protein 0.0013 0.001 0.0009
Echinococcus multilocularis cpg binding protein 0.0032 0.0059 0.0274
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0019 0.0119
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0068 0.0153 0.0446
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Loa Loa (eye worm) hypothetical protein 0.0106 0.0253 0.0252
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0025 0.213
Echinococcus multilocularis lamin dm0 0.0028 0.0049 0.0231
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.0293 0.0293
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0025 0.0025
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0019 0.0088
Loa Loa (eye worm) POT family protein 0.004 0.0081 0.0081
Plasmodium falciparum histone acetyltransferase GCN5 0.0041 0.0082 1
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0042 0.2203
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0041 0.1956
Loa Loa (eye worm) hypothetical protein 0.0064 0.0143 0.0143
Brugia malayi TAR-binding protein 0.0062 0.0138 0.0138
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0156 1
Echinococcus multilocularis integrin alpha ps 0.0067 0.0152 0.0713
Loa Loa (eye worm) hypothetical protein 0.0032 0.0061 0.006
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0042 0.4421
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Onchocerca volvulus 0.0114 0.0274 0.1507
Brugia malayi CXXC zinc finger family protein 0.003 0.0054 0.0054
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0025 0.0051
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0019 0.0067
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0138 0.04
Loa Loa (eye worm) TATA binding protein associated factor 0.0013 0.001 0.0009
Loa Loa (eye worm) peptidase family M1 containing protein 0.0013 0.001 0.0009
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0025 0.0117
Loa Loa (eye worm) hypothetical protein 0.0114 0.0273 0.0273
Brugia malayi POT family protein 0.004 0.0081 0.0081
Onchocerca volvulus 0.0025 0.0041 0.0177
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0041 0.0407
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0042 0.0465
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0268 0.0678 0.0678
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0437 0.5611
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0304 0.0771 1
Schistosoma mansoni hypothetical protein 0.0106 0.0253 0.0748
Leishmania major hypothetical protein, conserved 0.0025 0.0042 0.2031
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.009 0.1061
Echinococcus multilocularis integrin alpha 3 0.0115 0.0277 0.13
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 0.0277 0.0701 0.0701
Echinococcus granulosus histone acetyltransferase KAT2B 0.0146 0.0359 0.1286
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0195 0.0487 0.0487
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0195 0.0487 0.1744
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0019 0.0119
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0195 0.0487 0.0487
Echinococcus multilocularis geminin 0.0345 0.0878 0.412
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Schistosoma mansoni hypothetical protein 0.0016 0.0019 0.0041
Echinococcus multilocularis endothelin converting enzyme 1 0.0277 0.0701 0.3291
Loa Loa (eye worm) hypothetical protein 0.0013 0.001 0.0009
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0049 0.0049
Onchocerca volvulus 0.0106 0.0253 0.1386
Schistosoma mansoni intermediate filament proteins 0.0028 0.0049 0.0133
Brugia malayi Peptidase family M1 containing protein 0.0013 0.001 0.001
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0041 0.0448
Schistosoma mansoni endothelin-converting enzyme-related 0.0068 0.0153 0.0446
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0068 0.0153 0.0446
Echinococcus granulosus endothelin converting enzyme 1 0.0277 0.0701 0.2513
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0016 0.0019 0.0621
Toxoplasma gondii exonuclease III APE 0.0019 0.0025 0.0224
Brugia malayi RNA binding protein 0.0062 0.0138 0.0138
Schistosoma mansoni integrin alpha 0.015 0.0369 0.1101
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0069 0.0156 0.1918
Onchocerca volvulus Deterin homolog 0.0106 0.0253 0.1386
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0168 0.0492
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0148 0.0364 0.504
Loa Loa (eye worm) peptidase family M13 containing protein 0.0205 0.0512 0.0512
Echinococcus multilocularis aminopeptidase N 0.0013 0.001 0.0044
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0068 0.0153 0.0446
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0016 0.0019 0.0119
Brugia malayi hypothetical protein 0.0013 0.001 0.001
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0025 0.0979
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0013 0.001 0.0044
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0041 0.0278
Schistosoma mansoni hypothetical protein 0.0345 0.0878 0.2643
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0168 0.2289
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.009 0.5531
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0024 0.2019
Schistosoma mansoni hypothetical protein 0.0035 0.0069 0.0191
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0138 0.0137
Echinococcus granulosus integrin alpha 3 0.0115 0.0277 0.0993
Brugia malayi Peptidase family M1 containing protein 0.0013 0.001 0.001
Echinococcus granulosus lamin dm0 0.0028 0.0049 0.0176
Echinococcus multilocularis lamin 0.0028 0.0049 0.0231
Echinococcus multilocularis integrin alpha ps 0.0067 0.0152 0.0713
Brugia malayi hypothetical protein 0.0016 0.0019 0.0019
Onchocerca volvulus Glucosylceramidase homolog 0.0176 0.0437 0.2436
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0024 0.1782
Loa Loa (eye worm) hypothetical protein 0.0683 0.1762 0.1762
Toxoplasma gondii peptidase family M13 protein 0.0277 0.0701 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0012 0.0011
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0156 1
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0069 0.0156 0.0557
Giardia lamblia Histone acetyltransferase GCN5 0.0041 0.0082 0.0768
Loa Loa (eye worm) hypothetical protein 0.0013 0.001 0.001
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0025 0.5
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0019 0.0067
Loa Loa (eye worm) hypothetical protein 0.0277 0.0701 0.0701
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0025 0.0224
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0016 0.0019 0.0052
Loa Loa (eye worm) hypothetical protein 0.0028 0.0048 0.0048
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0019 0.0119
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Echinococcus granulosus ephrin type A receptor 4 A 0.0065 0.0145 0.052
Echinococcus multilocularis GPCR, family 2 0.0016 0.0019 0.0088
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0025 0.1062
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0124 0.0299 0.089
Loa Loa (eye worm) hypothetical protein 0.0137 0.0335 0.0335
Loa Loa (eye worm) hypothetical protein 0.0025 0.0041 0.004
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.0092 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.0491 0.2303
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0068 0.0153 0.0446
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0168 0.0787
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Trypanosoma brucei glucosidase, putative 0.0044 0.009 0.5531
Trypanosoma brucei glycosyl hydrolase-like protein 0.0016 0.0019 0.0621
Loa Loa (eye worm) peptidase family M13 containing protein 0.0205 0.0512 0.0512
Schistosoma mansoni cpg binding protein 0.0032 0.0059 0.0161
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0013 0.001 0.0033
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0042 0.3903
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0148 0.0364 0.5127
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0024 0.0039
Loa Loa (eye worm) hypothetical protein 0.0118 0.0285 0.0284
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0019 0.0088
Loa Loa (eye worm) hypothetical protein 0.0205 0.0512 0.0512
Brugia malayi hypothetical protein 0.0025 0.0042 0.0042
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Loa Loa (eye worm) hypothetical protein 0.0277 0.0701 0.0701
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0041 0.1956
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0013 0.001 0.0044
Onchocerca volvulus Phospholipase A2 homolog 0.0683 0.1762 1
Schistosoma mansoni alpha glucosidase 0.0044 0.009 0.0257
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0019 0.0019
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0823 0.2131 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.009 0.1061
Schistosoma mansoni aminopeptidase A (M01 family) 0.0013 0.001 0.0012
Echinococcus granulosus neuropeptide s receptor 0.048 0.1233 0.4418
Echinococcus granulosus baculoviral IAP repeat containing protein 0.0106 0.0253 0.0904
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0019 0.0119
Trichomonas vaginalis maltase-glucoamylase, putative 0.0016 0.0019 0.0119
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0106 0.0253 0.0253
Schistosoma mansoni alpha-glucosidase 0.0169 0.0419 0.1253
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0168 0.0492
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.009 0.5531
Loa Loa (eye worm) aminopeptidase N 0.0013 0.001 0.0009
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0069 0.0156 0.0156
Echinococcus multilocularis musashi 0.0028 0.0049 0.0231
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0134 0.1793
Brugia malayi Glycosyl hydrolases family 31 protein 0.0044 0.009 0.009
Brugia malayi Glycosyl hydrolases family 31 protein 0.0197 0.0491 0.0491
Loa Loa (eye worm) hypothetical protein 0.0018 0.0024 0.0024
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0016 0.0019 0.0621
Brugia malayi intermediate filament protein 0.0028 0.0049 0.0049
Echinococcus granulosus neutral alpha glucosidase AB 0.0044 0.009 0.0323
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0168 0.2289
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0013 0.001 0.0044
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0168 0.2289
Mycobacterium ulcerans zinc metalloprotease 0.0277 0.0701 1
Schistosoma mansoni lamin 0.0028 0.0049 0.0133
Trichomonas vaginalis glucosylceramidase, putative 0.0268 0.0678 0.8782
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0025 0.1062
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0015 0.0015
Loa Loa (eye worm) hypothetical protein 0.021 0.0525 0.0524
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Loa Loa (eye worm) hypothetical protein 0.0028 0.0049 0.0049
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0231 0.0582 0.1745
Echinococcus granulosus lysosomal alpha glucosidase 0.0197 0.0491 0.1758
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0013 0.001 0.0012
Schistosoma mansoni hypothetical protein 0.0072 0.0165 0.0484
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0168 1
Echinococcus granulosus lamin 0.0028 0.0049 0.0176
Echinococcus granulosus integrin alpha ps 0.0032 0.0061 0.0216
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0195 0.0487 0.1744
Mycobacterium ulcerans hypothetical protein 0.0025 0.0041 0.0448
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0041 0.0448
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.0771 1
Echinococcus granulosus cpg binding protein 0.0032 0.0059 0.0209
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.009 0.1061
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0069 0.0156 0.0454
Giardia lamblia Fructose-bisphosphate aldolase 0.0304 0.0771 1
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.0461 0.5937

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) > 71.485 uM PUBCHEM_BIOASSAY: Fluorescence-based biochemical high throughput dose response assay for activators of the calcium sensitivity of cardiac Regulated Thin Filaments (RTF). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493008, AID493018, AID504382, AID504383] ChEMBL. No reference
Potency (functional) = 0.8913 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ] ChEMBL. No reference
Potency (functional) = 0.8913 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ] ChEMBL. No reference
Potency (functional) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 50.1187 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

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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