TDR Targets

Basic information

Technical information

TDR Targets ID: 1265060
Name: 4-methoxy-N-(2-morpholin-4-yl-2-oxoethyl)-N-( phenylmethyl)benzenesulfonamide
MW: 404.48 | Formula: C20H24N2O5S
H donors: 0 H acceptors: 3 LogP: 1.69 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1)S(=O)(=O)N(CC(=O)N1CCOCC1)Cc1ccccc1
InChi: 1S/C20H24N2O5S/c1-26-18-7-9-19(10-8-18)28(24,25)22(15-17-5-3-2-4-6-17)16-20(23)21-11-13-27-14-12-21/h2-10H,11-16H2,1H3
InChiKey: LZMWOKCGYZPRQS-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

4-methoxy-N-(2-morpholino-2-oxo-ethyl)-N-(phenylmethyl)benzenesulfonamide
4-methoxy-N-(2-morpholino-2-oxoethyl)-N-(phenylmethyl)benzenesulfonamide
N-(benzyl)-N-(2-keto-2-morpholino-ethyl)-4-methoxy-benzenesulfonamide
4-methoxy-N-(2-morpholin-4-yl-2-oxo-ethyl)-N-(phenylmethyl)benzenesulfonamide
MLS000067485
ZINC04559256
BAS 05400164
N-Benzyl-4-methoxy-N-(2-morpholin-4-yl-2-oxo-ethyl)-benzenesulfonamide
SMR000124973

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
Brugia malayi	Animal haem peroxidase family protein	0.0298	1	1
Brugia malayi	notch-like transmembrane receptor	0.0096	0.2834	0.2829
Onchocerca volvulus		0.0298	1	1
Echinococcus multilocularis	neurogenic locus protein delta	0.0096	0.2834	0.2751
Plasmodium falciparum	ABC transporter G family member 2	0.002	0.0115	0.5
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	animal heme peroxidase	0.0298	1	1
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Schistosoma mansoni	slit	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Echinococcus granulosus	neural cadherin	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Echinococcus granulosus	peroxidasin	0.0298	1	1
Brugia malayi	Animal haem peroxidase family protein	0.0298	1	1
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Echinococcus granulosus	fibropellin Ia	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Brugia malayi	Muscle positioning protein 4	0.0096	0.2834	0.2829
Echinococcus granulosus	neurogenic locus protein delta	0.0096	0.2834	0.2751
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0096	0.2834	0.2829
Giardia lamblia	High cysteine protein	0.0096	0.2834	1
Echinococcus multilocularis	protein jagged 2	0.0096	0.2834	0.2751
Echinococcus multilocularis	fat cadherin tumor suppressor	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Schistosoma mansoni	ATP-binding cassette sub-family g2 (white protein) (abcg2)	0.002	0.0115	0.0115
Schistosoma mansoni	cell polarity protein	0.0096	0.2834	0.2834
Plasmodium vivax	ABC transporter G family member 2, putative	0.002	0.0115	0.5
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Echinococcus multilocularis	notch	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Echinococcus granulosus	notch	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Schistosoma mansoni	septate junction protein	0.0096	0.2834	0.2834
Echinococcus granulosus	neurogenic locus notch protein	0.0096	0.2834	0.2751
Loa Loa (eye worm)	animal heme peroxidase	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Echinococcus multilocularis	peroxidasin	0.0298	1	1
Brugia malayi	Blistered cuticle protein 3	0.0298	1	1
Echinococcus multilocularis	neurogenic locus notch protein	0.0096	0.2834	0.2751
Echinococcus multilocularis	slit 2 protein	0.0096	0.2834	0.2751
Leishmania major	ATP-binding cassette protein subfamily G, member 4, putative	0.002	0.0115	0.5
Loa Loa (eye worm)	blistered cuticle protein 3	0.0298	1	1
Echinococcus granulosus	delta-like protein 1	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Onchocerca volvulus	Peroxidasin homolog	0.0298	1	1
Echinococcus multilocularis	protein jagged 1	0.0096	0.2834	0.2751
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.0096	0.2834	0.2834
Trypanosoma cruzi	ABC transporter, putative	0.002	0.0115	0.5
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.002	0.0115	0.5
Trypanosoma cruzi	ATP-binding cassette protein, putative	0.002	0.0115	0.5
Brugia malayi	Delta serrate ligand family protein	0.0096	0.2834	0.2829
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Loa Loa (eye worm)	animal heme peroxidase	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Echinococcus granulosus	protein jagged 2	0.0096	0.2834	0.2751
Brugia malayi	Cadherin domain containing protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Loa Loa (eye worm)	animal heme peroxidase	0.0298	1	1
Echinococcus granulosus	protein jagged 2	0.0096	0.2834	0.2751
Echinococcus multilocularis	protein jagged 1	0.0096	0.2834	0.2751
Schistosoma mansoni	ABC transporter	0.0017	0.0008	0.0008
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Onchocerca volvulus		0.0298	1	1
Loa Loa (eye worm)	Notch2	0.0096	0.2834	0.2829
Brugia malayi	Calcium binding EGF domain containing protein	0.0096	0.2834	0.2829
Echinococcus multilocularis	fibropellin Ia	0.0096	0.2834	0.2751
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.002	0.0115	0.5
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Brugia malayi	Animal haem peroxidase family protein	0.0298	1	1
Echinococcus granulosus	protein jagged 1	0.0096	0.2834	0.2751
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Toxoplasma gondii	EGF family domain-containing protein	0.0096	0.2834	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	notch protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Brugia malayi	EGF-like domain containing protein	0.0096	0.2834	0.2829
Trypanosoma brucei	ATP-binding cassette protein, putative	0.002	0.0115	0.5
Onchocerca volvulus		0.0298	1	1
Schistosoma mansoni	peroxidasin	0.0298	1	1
Echinococcus multilocularis	neurogenic locus protein delta	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Onchocerca volvulus	Peroxidase homolog	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Onchocerca volvulus	Dual oxidase homolog	0.0298	1	1
Brugia malayi	Peroxidasin	0.0298	1	1
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Echinococcus multilocularis	neurogenic locus notch protein 4	0.0096	0.2834	0.2751
Echinococcus multilocularis	neurogenic locus notch protein	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Onchocerca volvulus	Peroxidasin homolog	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Echinococcus granulosus	neurogenic locus notch protein	0.0096	0.2834	0.2751
Brugia malayi	Animal haem peroxidase family protein	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Schistosoma mansoni	laminin gamma-3 chain	0.0096	0.2834	0.2834
Brugia malayi	Animal haem peroxidase family protein	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Brugia malayi	Cadherin domain containing protein	0.0096	0.2834	0.2829
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Echinococcus multilocularis	neural cadherin	0.0096	0.2834	0.2751
Leishmania major	ATP-binding cassette protein subfamily G, member 6, putative	0.002	0.0115	0.5
Echinococcus granulosus	slit 2 protein	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Onchocerca volvulus	Chorion peroxidase homolog	0.0298	1	1
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Loa Loa (eye worm)	hypothetical protein	0.0298	1	1
Schistosoma mansoni	hypothetical protein	0.0096	0.2834	0.2834
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.002	0.0115	0.5
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Brugia malayi	Calcium binding EGF domain containing protein	0.0096	0.2834	0.2829
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Onchocerca volvulus	Peroxidase homolog	0.0298	1	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Brugia malayi	Calcium binding EGF domain containing protein	0.0096	0.2834	0.2829
Trypanosoma brucei	ABC transporter, putative	0.002	0.0115	0.5
Brugia malayi	GCC2 and GCC3 family protein	0.0096	0.2834	0.2829
Echinococcus granulosus	neurogenic locus notch protein 4	0.0096	0.2834	0.2751
Loa Loa (eye worm)	hypothetical protein	0.0096	0.2834	0.2829
Entamoeba histolytica	ABC transporter, putative	0.002	0.0115	0.5
Echinococcus granulosus	protein jagged 1	0.0096	0.2834	0.2751
Schistosoma mansoni	notch	0.0096	0.2834	0.2834
Schistosoma mansoni	peroxidasin	0.0298	1	1
Mycobacterium tuberculosis	Probable conserved transmembrane ATP-binding protein ABC transporter	0.0016	0	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.0058 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)	3.9811 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	18.526 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 22.3872 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)	32.6427 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

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.

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

ChEMBL: CHEMBL1361795

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1265060