TDR Targets

Basic information

Technical information

TDR Targets ID: 864264
Name: N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsu lfonyl-2-pyridin-4-ylquinoline-4-carboxamide
MW: 502.585 | Formula: C27H26N4O4S
H donors: 1 H acceptors: 5 LogP: 2.69 Rotable bonds: 7
Rule of 5 violations (Lipinski): 2
SMILES: Cc1ccc(cc1)CNC(=O)c1cc(nc2c1cc(cc2)S(=O)(=O)N1CCOCC1)c1ccncc1
InChi: 1S/C27H26N4O4S/c1-19-2-4-20(5-3-19)18-29-27(32)24-17-26(21-8-10-28-11-9-21)30-25-7-6-22(16-23(24)25)36(33,34)31-12-14-35-15-13-31/h2-11,16-17H,12-15,18H2,1H3,(H,29,32)
InChiKey: OXLIRUPFRCMTJX-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

N-[(4-methylphenyl)methyl]-6-morpholinosulfonyl-2-(4-pyridyl)quinoline-4-carboxamide
N-[(4-methylphenyl)methyl]-6-morpholinosulfonyl-2-(4-pyridyl)-4-quinolinecarboxamide
N-(4-methylbenzyl)-6-morpholinosulfonyl-2-(4-pyridyl)cinchoninamide
N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-yl-quinoline-4-carboxamide

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	Papain family cysteine protease containing protein	0.0025	0.0846	0.0846
Loa Loa (eye worm)	hypothetical protein	0.015	1	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0025	0.0846	0.0846
Echinococcus granulosus	cathepsin b	0.015	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.009	0.5604	0.5604
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Trypanosoma cruzi	cysteine peptidase, putative	0.0025	0.0846	0.0846
Schistosoma mansoni	cathepsin F (C01 family)	0.0044	0.2247	0.2247
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0054	0.3017	0.2295
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0025	0.0846	0.0846
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Entamoeba histolytica	cysteine proteinase, putative	0.0031	0.1292	0.3182
Giardia lamblia	Cathepsin B precursor	0.0054	0.3017	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Loa Loa (eye worm)	hypothetical protein	0.0119	0.7787	0.7787
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Echinococcus granulosus	cathepsin b	0.015	1	1
Onchocerca volvulus		0.0044	0.2247	0.147
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0025	0.0846	0.0846
Echinococcus multilocularis	cathepsin b	0.015	1	1
Onchocerca volvulus		0.0044	0.2247	0.147
Onchocerca volvulus	Cathepsin L homolog	0.0044	0.2247	0.147
Echinococcus multilocularis	cysteine protease	0.0044	0.2247	0.153
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Loa Loa (eye worm)	cathepsin B	0.0054	0.3017	0.3017
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Loa Loa (eye worm)	hypothetical protein	0.0031	0.1292	0.1292
Onchocerca volvulus		0.0044	0.2247	0.147
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.2309	0.2309
Trypanosoma cruzi	cruzipain precursor, putative	0.009	0.5604	0.5604
Entamoeba histolytica	cysteine proteinase, putative	0.0044	0.2247	1
Onchocerca volvulus		0.0044	0.2247	0.147
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0025	0.0846	0.0846
Plasmodium vivax	unspecified product	0.0025	0.0846	0.3765
Echinococcus multilocularis	cathepsin L cysteine protease	0.0044	0.2247	0.153
Plasmodium vivax	vivapain-2	0.0044	0.2247	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0054	0.3017	0.4563
Plasmodium vivax	vivapain-2	0.0044	0.2247	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0044	0.2247	0.6451
Brugia malayi	Cathepsin L-like precursor	0.0031	0.1292	0.1292
Onchocerca volvulus		0.0044	0.2247	0.147
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0044	0.2247	0.2247
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0054	0.3017	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.2309	0.1598
Toxoplasma gondii	cathepsin B	0.0054	0.3017	1
Brugia malayi	cathepsin L-like precursor	0.0031	0.1292	0.1292
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.1292	0.1292
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0044	0.2247	0.153
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Brugia malayi	Papain family cysteine protease containing protein	0.0044	0.2247	0.2247
Loa Loa (eye worm)	fibroinase	0.0044	0.2247	0.2247
Leishmania major	cathepsin L-like protease	0.009	0.5604	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trypanosoma cruzi	cysteine peptidase, putative	0.0044	0.2247	0.2247
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0044	0.2247	0.6451
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.2309	0.2309
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0044	0.2247	0.2247
Loa Loa (eye worm)	hypothetical protein	0.0119	0.7787	0.7787
Loa Loa (eye worm)	hypothetical protein	0.0031	0.1292	0.1292
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0031	0.1292	0.1292
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Giardia lamblia	Cathepsin B precursor	0.0054	0.3017	0.5
Entamoeba histolytica	cysteine protease, putative	0.0044	0.2247	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.2309	0.2309
Trypanosoma cruzi	cysteine peptidase, putative	0.009	0.5604	0.5604
Echinococcus multilocularis	cysteine protease	0.0044	0.2247	0.153
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.015	1	1
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Echinococcus multilocularis	cathepsin b	0.015	1	1
Trypanosoma cruzi	cysteine protease, putative	0.0025	0.0846	0.0846
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.015	1	1
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Plasmodium vivax	vivapain-3	0.0025	0.0846	0.3765
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0077	0.4649	0.4649
Entamoeba histolytica	cysteine proteinase, putative	0.0044	0.2247	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.015	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0031	0.1292	0.1292
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Schistosoma mansoni	cathepsin F (C01 family)	0.0044	0.2247	0.2247
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.015	1	1
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Echinococcus multilocularis	cathepsin L cysteine protease	0.0044	0.2247	0.153
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Leishmania major	cathepsin L-like protease	0.009	0.5604	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0025	0.0846	0.0846
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0054	0.3017	0.3017
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0044	0.2247	0.153
Plasmodium vivax	vivapain-1	0.0025	0.0846	0.3765
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0044	0.2247	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.2309	0.2309
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0044	0.2247	0.153
Onchocerca volvulus		0.0044	0.2247	0.147
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.2309	0.1598
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Echinococcus granulosus	cathepsin l1	0.0044	0.2247	0.153
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Loa Loa (eye worm)	ctsf protein	0.0044	0.2247	0.2247
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0031	0.1292	0.2053
Onchocerca volvulus	Cathepsin F homolog	0.0044	0.2247	0.147
Trypanosoma cruzi	cysteine proteinase, putative	0.0025	0.0846	0.0846
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0044	0.2247	1
Onchocerca volvulus	Huntingtin homolog	0.0119	0.7787	1
Brugia malayi	Cathepsin L-like precursor	0.0031	0.1292	0.1292
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.2309	0.1598
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0044	0.2247	0.153
Leishmania major	cathepsin L-like protease	0.009	0.5604	1
Loa Loa (eye worm)	cysteine protease	0.0044	0.2247	0.2247
Brugia malayi	hypothetical protein	0.0119	0.7787	0.7787
Brugia malayi	Papain family cysteine protease containing protein	0.0025	0.0846	0.0846
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.015	1	1
Trypanosoma cruzi	major cysteine proteinase, putative	0.0057	0.3248	0.3248
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.3017	0.3017
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Brugia malayi	Cathepsin L-like precursor	0.0044	0.2247	0.2247
Onchocerca volvulus		0.0044	0.2247	0.147
Loa Loa (eye worm)	hypothetical protein	0.0044	0.2247	0.2247
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.2309	0.2309
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0044	0.2247	1
Giardia lamblia	Cathepsin B precursor	0.0054	0.3017	0.5
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0044	0.2247	0.6451
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.2309	0.1598
Onchocerca volvulus	Cathepsin L homolog	0.0044	0.2247	0.147
Onchocerca volvulus	Huntingtin homolog	0.0119	0.7787	1
Echinococcus granulosus	cathepsin l1	0.0031	0.1292	0.0487
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.5604	1
Trypanosoma cruzi	cysteine peptidase, putative	0.009	0.5604	0.5604
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0044	0.2247	0.6451
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0031	0.1292	0.2053

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 864264