TDR Targets

Basic information

Technical information

TDR Targets ID: 716602
Name: 2-(2-ethoxy-4-formylphenoxy)-N-(4-morpholin-4 -ylphenyl)acetamide
MW: 384.426 | Formula: C21H24N2O5
H donors: 1 H acceptors: 2 LogP: 2.35 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1cc(C=O)ccc1OCC(=O)Nc1ccc(cc1)N1CCOCC1
InChi: 1S/C21H24N2O5/c1-2-27-20-13-16(14-24)3-8-19(20)28-15-21(25)22-17-4-6-18(7-5-17)23-9-11-26-12-10-23/h3-8,13-14H,2,9-12,15H2,1H3,(H,22,25)
InChiKey: LTJSEGDRYUQBAY-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

2-(2-ethoxy-4-formyl-phenoxy)-N-(4-morpholinophenyl)acetamide
2-(2-ethoxy-4-formylphenoxy)-N-(4-morpholinophenyl)acetamide
2-(2-ethoxy-4-methanoyl-phenoxy)-N-(4-morpholin-4-ylphenyl)ethanamide
ZINC04865950

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Mycobacterium tuberculosis	Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0396	0.0069
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0007	0.0396	0.0069
Trypanosoma cruzi	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0396	1
Echinococcus multilocularis	short transient receptor potential channel 6	0.0003	0.0153	0.064
Leishmania major	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0396	0.2557
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.1069	0.0765
Loa Loa (eye worm)	hypothetical protein	0.0017	0.1136	0.4006
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1548	0.5659
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0003	0.0136	0.0882
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0007	0.0396	0.0069
Toxoplasma gondii	AMP-binding enzyme domain-containing protein	0.0007	0.0396	1
Mycobacterium tuberculosis	Probable NADH dehydrogenase I (chain H) NuoH (NADH-ubiquinone oxidoreductase chain H)	0.0144	1	1
Trypanosoma cruzi	acetyl-CoA synthetase, putative	0.0007	0.0396	1
Mycobacterium tuberculosis	Possible formate hydrogenlyase HycD (FHL)	0.0039	0.2631	0.238
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0396	0.0069
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.1548	1
Toxoplasma gondii	Acetyl-coenzyme A synthetase 2, putative	0.0007	0.0396	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.1548	1
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Brugia malayi	acetyl-Coenzyme A synthetase 2	0.0007	0.0396	0.104
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.1548	0.5659
Echinococcus multilocularis	transient receptor potential cation channel	0.0003	0.0136	0.0000043639
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.1548	0.12
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.1069	0.0765
Brugia malayi	NADH dehydrogenase subunit 1, identical	0.0039	0.2631	1
Onchocerca volvulus		0.0007	0.0396	0.104
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0017	0.1136	0.5
Echinococcus granulosus	transient receptor potential cation channel	0.0003	0.0153	0.0017
Schistosoma mansoni	hypothetical protein	0.0144	1	1
Echinococcus granulosus	short transient receptor potential channel 6	0.0003	0.0153	0.0017
Echinococcus granulosus	acetyl coenzyme A synthetase cytoplasmic	0.0007	0.0396	0.0263
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.1548	0.5659
Loa Loa (eye worm)	NADH dehydrogenase subunit 1	0.0039	0.2631	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.1548	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.1136	0.4006
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0007	0.0396	0.0069
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.1548	0.12
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.1548	0.12
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0017	0.1136	0.077
Onchocerca volvulus		0.0007	0.0396	0.104
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0136	0.00000045363
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Loa Loa (eye worm)	hypothetical protein	0.0017	0.1136	0.4006
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Onchocerca volvulus		0.0039	0.2631	1
Onchocerca volvulus		0.0007	0.0396	0.104
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.1548	0.5659
Mycobacterium tuberculosis	Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase)	0.0007	0.0396	0.0069
Echinococcus granulosus	transient receptor potential cation channel	0.0003	0.0136	0.00000011473
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1548	0.5659
Trypanosoma brucei	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0396	1
Leishmania major	acetyl-CoA synthetase, putative	0.0007	0.0396	0.2557
Brugia malayi	olfactory channel protein osm-9	0.0003	0.0153	0.0067
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0007	0.0396	0.0069
Echinococcus multilocularis	acetyl coenzyme A synthetase, cytoplasmic	0.0007	0.0396	1
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0396	0.104
Onchocerca volvulus		0.0023	0.1548	0.5659
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0396	0.104
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.1548	0.12
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0153	0.0067
Schistosoma mansoni	transient receptor potential channel	0.0003	0.0153	0.0017
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.1069	0.0765
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.1548	0.12
Trypanosoma cruzi	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0396	1
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0396	0.0069
Leishmania major	acetyl-CoA synthetase, putative	0.0007	0.0396	0.2557
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.1548	1
Brugia malayi	hypothetical protein	0.0039	0.2631	1
Schistosoma mansoni	acetyl-CoA synthetase	0.0007	0.0396	0.0263
Onchocerca volvulus		0.0039	0.2631	1
Schistosoma mansoni	transient receptor potential channel	0.0003	0.0136	0.00000011473
Leishmania major	hypothetical protein, unknown function	0.0003	0.0136	0.0882
Plasmodium falciparum	acyl-CoA synthetase	0.0017	0.1136	1
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.1548	0.126
Loa Loa (eye worm)	hypothetical protein	0.0017	0.1136	0.4006
Wolbachia endosymbiont of Brugia malayi	NADH dehydrogenase subunit H	0.0144	1	0.5
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.1548	1
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Onchocerca volvulus		0.0007	0.0396	0.104
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0396	0.104
Schistosoma mansoni	NADH dehydrogenase subunit 1	0.0039	0.2631	0.2529
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.1548	0.126
Trypanosoma cruzi	acetyl-CoA synthetase, putative	0.0007	0.0396	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0003	0.0153	0.064
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.1548	0.12
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.1069	0.0765
Echinococcus multilocularis	transient receptor potential cation channel	0.0003	0.0153	0.064
Toxoplasma gondii	propionate-CoA ligase	0.0007	0.0396	1
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0007	0.0396	0.0069
Leishmania major	hypothetical protein, conserved	0.0003	0.0136	0.0882
Mycobacterium ulcerans	NADH dehydrogenase subunit H	0.0144	1	1
Loa Loa (eye worm)	oxidoreductase	0.0007	0.0396	0.104
Mycobacterium ulcerans	formate hydrogenlyase HycD	0.0039	0.2631	0.2327
Brugia malayi	NADH dehydrogenase subunit 1	0.0039	0.2631	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.1548	1
Plasmodium vivax	acyl-CoA synthetase, putative	0.0017	0.1136	1
Echinococcus granulosus	transient receptor potential cation channel	0.0003	0.0136	0.00000011473
Schistosoma mansoni	transient receptor potential channel	0.0003	0.0136	0.00000011473
Loa Loa (eye worm)	hypothetical protein	0.0017	0.1136	0.4006
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0136	0.00000045363
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1548	0.5659
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0007	0.0396	0.104
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.1548	1
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0396	1
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0396	0.0069
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0007	0.0396	0.0069
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0396	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.1548	1
Mycobacterium ulcerans	hypothetical protein	0.0023	0.1548	0.12
Trypanosoma brucei	acetyl-CoA synthetase, putative	0.0007	0.0396	1
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.1136	0.0834
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.1548	0.12

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.

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External resources for this compound

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 716602