Detailed information for compound 756461

Basic information

Technical information
  • TDR Targets ID: 756461
  • Name: 2-morpholin-4-yl-5-[(4-prop-2-enoxyphenyl)met hylidene]-1,3-thiazol-4-one
  • MW: 330.401 | Formula: C17H18N2O3S
  • H donors: 0 H acceptors: 1 LogP: 2.7 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=CCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCOCC1
  • InChi: 1S/C17H18N2O3S/c1-2-9-22-14-5-3-13(4-6-14)12-15-16(20)18-17(23-15)19-7-10-21-11-8-19/h2-6,12H,1,7-11H2/b15-12+
  • InChiKey: XLRRVVKABWCRIT-NTCAYCPXSA-N  

Network

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Synonyms

  • (5E)-2-morpholin-4-yl-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one
  • (5E)-5-[(4-allyloxyphenyl)methylene]-2-morpholino-thiazol-4-one
  • 5-[(4-allyloxyphenyl)methylene]-2-morpholino-thiazol-4-one
  • (5E)-5-[(4-allyloxyphenyl)methylene]-2-morpholino-4-thiazolone
  • 5-[(4-allyloxyphenyl)methylene]-2-morpholino-4-thiazolone
  • (5E)-5-(4-allyloxybenzylidene)-2-morpholino-thiazol-4-one
  • 5-(4-allyloxybenzylidene)-2-morpholino-thiazol-4-one
  • ZINC02295056
  • AF-399/40640769

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.1109 0.0967
Loa Loa (eye worm) hypothetical protein 0.0018 0.0229 0.0471
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0395 0.0857
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.1427 0.129
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0215 0.0466
Loa Loa (eye worm) hypothetical protein 0.0045 0.1114 0.2287
Schistosoma mansoni hypothetical protein 0.0148 0.4515 0.9789
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0836 0.1851
Brugia malayi PHD-finger family protein 0.0029 0.0593 0.1218
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0149 0.455 0.4463
Schistosoma mansoni hypothetical protein 0.0021 0.0333 0.0721
Brugia malayi MH2 domain containing protein 0.0134 0.4033 0.8283
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0424 0.0461
Schistosoma mansoni bromodomain containing protein 0.0067 0.1855 0.4022
Echinococcus multilocularis protein patched 0.0042 0.1027 0.2226
Schistosoma mansoni ferritin 0.0027 0.0538 0.1167
Loa Loa (eye worm) hypothetical protein 0.0109 0.3219 0.6611
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0159 0.4869 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0139 0.4226 0.9161
Echinococcus multilocularis protein dispatched 1 0.0048 0.1221 0.2646
Schistosoma mansoni ferritin 0.0027 0.0538 0.1167
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0229 0.0064
Schistosoma mansoni thyroid hormone receptor 0.0142 0.4313 0.935
Loa Loa (eye worm) hypothetical protein 0.005 0.1304 0.2678
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0739 0.3192
Echinococcus granulosus histone acetyltransferase KAT2B 0.0145 0.4398 0.974
Mycobacterium ulcerans hypothetical protein 0.0023 0.0424 0.04
Brugia malayi Calcitonin receptor-like protein seb-1 0.0159 0.4869 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0395 0.0876
Loa Loa (eye worm) hypothetical protein 0.0042 0.1027 0.2108
Mycobacterium tuberculosis Probable bacterioferritin BfrA 0.0027 0.0538 0.0694
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0033 0.0739 0.1518
Loa Loa (eye worm) hypothetical protein 0.0023 0.0424 0.0871
Echinococcus granulosus sterol regulatory element binding protein 0.0042 0.1027 0.2274
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.0713 0.0565
Echinococcus multilocularis Niemann Pick C1 protein 0.0098 0.2853 0.6185
Brugia malayi CHE-14 protein 0.0042 0.1027 0.2108
Schistosoma mansoni hypothetical protein 0.0015 0.0157 0.0341
Loa Loa (eye worm) hypothetical protein 0.0018 0.0229 0.0471
Mycobacterium ulcerans bacterioferritin BfrB 0.0027 0.0538 0.0634
Brugia malayi latrophilin 2 splice variant baaae 0.0109 0.3219 0.6611
Brugia malayi Niemann-Pick C1 protein precursor 0.0098 0.2853 0.5859
Schistosoma mansoni patched 1 0.0042 0.1027 0.2226
Echinococcus multilocularis expressed protein 0.0033 0.0739 0.1602
Echinococcus multilocularis thyroid hormone receptor alpha 0.0142 0.4313 0.935
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.0027 0.0538 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0424 0.04
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.005 0.1304 0.2827
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.1109 0.0967
Echinococcus multilocularis expressed conserved protein 0.0092 0.2659 0.5764
Schistosoma mansoni apoferritin-2 0.0027 0.0538 0.1167
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0099 0.2902 0.6292
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.1109 0.0967
Treponema pallidum bacterioferrin (TpF1) 0.0027 0.0538 0.5
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0215 0.0466
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0064 0.1737 0.3848
Giardia lamblia Histone acetyltransferase GCN5 0.004 0.097 0.5
Schistosoma mansoni hypothetical protein 0.005 0.1304 0.2827
Loa Loa (eye worm) hypothetical protein 0.0038 0.0916 0.1882
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0148 0.4515 0.9789
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0424 0.04
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.0713 0.0565
Loa Loa (eye worm) hypothetical protein 0.0071 0.198 0.4068
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0424 0.0461
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0149 0.455 0.4463
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0159 0.4869 1
Schistosoma mansoni zinc finger protein 0.0015 0.0157 0.0341
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0424 0.0871
Loa Loa (eye worm) hypothetical protein 0.0023 0.0424 0.0871
Mycobacterium tuberculosis Conserved hypothetical protein 0.0166 0.5103 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0046 0.1167 0.2585
Trichomonas vaginalis bromodomain-containing protein, putative 0.0046 0.1167 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0424 0.0871
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0046 0.1167 1
Loa Loa (eye worm) transcription factor SMAD2 0.0134 0.4033 0.8283
Loa Loa (eye worm) hypothetical protein 0.0018 0.0229 0.0471
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0148 0.4515 1
Schistosoma mansoni ferritin 0.0027 0.0538 0.1167
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0132 0.3966 0.8599
Loa Loa (eye worm) hypothetical protein 0.0046 0.1176 0.2416
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0424 0.0271
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.005 0.1304 0.2827
Echinococcus multilocularis GPCR, family 2 0.005 0.1304 0.2827
Schistosoma mansoni hypothetical protein 0.004 0.0977 0.2118
Mycobacterium tuberculosis Bacterioferritin BfrB 0.0027 0.0538 0.0694
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0333 0.0683
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0132 0.3966 0.8785
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0151 0.4613 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0424 0.0871
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0355 0.0728
Schistosoma mansoni hypothetical protein 0.005 0.1304 0.2827
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0098 0.2853 0.5936
Brugia malayi Bromodomain containing protein 0.0079 0.2241 0.4602
Loa Loa (eye worm) hypothetical protein 0.0018 0.0229 0.0471
Toxoplasma gondii hypothetical protein 0.0051 0.1323 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0424 0.0271
Schistosoma mansoni thyroid hormone receptor 0.0142 0.4313 0.935
Entamoeba histolytica hypothetical protein 0.0148 0.4515 1
Schistosoma mansoni rotamase 0.0033 0.0739 0.1602
Brugia malayi acetyltransferase, GNAT family protein 0.0151 0.4613 0.9474
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0395 0.0857
Loa Loa (eye worm) hypothetical protein 0.0098 0.2853 0.5859
Entamoeba histolytica hypothetical protein 0.0148 0.4515 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0215 0.0476
Echinococcus granulosus Protein patched homolog 1 0.0042 0.1027 0.2274
Echinococcus multilocularis zinc finger protein 0.0023 0.0417 0.0905
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0316 1 1
Schistosoma mansoni hypothetical protein 0.005 0.1304 0.2827
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.1027 0.7766
Trichomonas vaginalis rotamase, putative 0.0033 0.0739 0.3192
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0424 0.04
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.097 0.1333
Loa Loa (eye worm) hypothetical protein 0.0017 0.0215 0.0441
Onchocerca volvulus 0.0023 0.0424 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0836 0.1812
Echinococcus granulosus ferritin 0.0027 0.0538 0.1193
Schistosoma mansoni transcription factor LCR-F1 0.0148 0.4515 0.9789
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0215 0.0476
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0316 1 1
Echinococcus multilocularis expressed protein 0.0027 0.0538 0.1167
Schistosoma mansoni hypothetical protein 0.004 0.0977 0.2118
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.097 1
Mycobacterium ulcerans bacterioferritin BfrA 0.0027 0.0538 0.0634
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0316 1 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.1335 0.2743
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0424 0.04
Schistosoma mansoni ferritin light chain 0.0027 0.0538 0.1167
Schistosoma mansoni hypothetical protein 0.005 0.1304 0.2827
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0424 0.04
Echinococcus multilocularis sterol regulatory element binding protein 0.0042 0.1027 0.2226
Schistosoma mansoni ferritin 0.0027 0.0538 0.1167
Loa Loa (eye worm) hypothetical protein 0.0159 0.4869 1
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0149 0.455 0.4463
Schistosoma mansoni hypothetical protein 0.0109 0.3219 0.6978
Brugia malayi Bromodomain containing protein 0.0042 0.1033 0.2122
Entamoeba histolytica hypothetical protein 0.0148 0.4515 1
Echinococcus granulosus expressed protein 0.0033 0.0739 0.1637
Loa Loa (eye worm) latrophilin receptor protein 2 0.005 0.1304 0.2678
Schistosoma mansoni zinc finger protein 0.0023 0.0417 0.0905
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0027 0.0538 0.5
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0032 0.0713 0.0565
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0229 0.5
Mycobacterium ulcerans hypothetical protein 0.0166 0.5103 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0215 0.0466
Echinococcus multilocularis ferritin 0.0027 0.0538 0.1167
Echinococcus granulosus Niemann Pick C1 protein 0.0098 0.2853 0.6318
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0032 0.0713 0.0565
Loa Loa (eye worm) acetyltransferase 0.0151 0.4613 0.9474
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0064 0.1737 0.3767
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0042 0.1027 0.2108
Schistosoma mansoni hypothetical protein 0.0132 0.3966 0.8599
Echinococcus granulosus GPCR family 2 0.005 0.1304 0.2888
Schistosoma mansoni apoferritin-2 0.0027 0.0538 0.1167
Loa Loa (eye worm) hypothetical protein 0.0018 0.0229 0.0471
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0046 0.1167 0.7447
Echinococcus granulosus zinc finger protein 0.0023 0.0417 0.0924
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0215 0.0466
Echinococcus granulosus Niemann Pick C1 protein 0.0139 0.4226 0.9359
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0424 0.0271
Schistosoma mansoni hypothetical protein 0.004 0.0977 0.2118
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0215 0.0466
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.005 0.1304 0.2888
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0046 0.1167 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0424 0.04
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0215 0.0466
Brugia malayi hypothetical protein 0.0148 0.4515 0.9274
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0424 0.0871
Echinococcus granulosus expressed protein 0.0027 0.0538 0.1193
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0032 0.0713 0.0707
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.1109 0.0967
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0046 0.1167 0.7447
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0033 0.0739 0.1518
Brugia malayi Latrophilin receptor protein 2 0.005 0.1304 0.2678
Echinococcus granulosus expressed conserved protein 0.0092 0.2659 0.5889
Schistosoma mansoni ferritin light chain 0.0027 0.0538 0.1167
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0424 0.04
Loa Loa (eye worm) MH2 domain-containing protein 0.0134 0.4033 0.8283
Schistosoma mansoni hypothetical protein 0.004 0.0977 0.2118
Trichomonas vaginalis rotamase, putative 0.0032 0.0713 0.2785
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.005 0.1304 0.2678
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.005 0.1304 0.2888
Entamoeba histolytica hypothetical protein 0.0148 0.4515 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0151 0.4613 1

Activities

No activities found for this compound.

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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