TDR Targets

Basic information

Technical information

TDR Targets ID: 657170
Name: N-[(4-chlorophenyl)methylideneamino]-2-(3-met hyl-5-oxo-1,4-dihydropyrazol-4-yl)acetamide
MW: 292.721 | Formula: C13H13ClN4O2
H donors: 2 H acceptors: 2 LogP: 1.07 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: O=C(CC1C(=NNC1=O)C)NN=Cc1ccc(cc1)Cl
InChi: 1S/C13H13ClN4O2/c1-8-11(13(20)18-16-8)6-12(19)17-15-7-9-2-4-10(14)5-3-9/h2-5,7,11H,6H2,1H3,(H,17,19)(H,18,20)/b15-7+
InChiKey: XVAKTUNBZPUHLI-VIZOYTHASA-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-chlorophenyl)methyleneamino]-2-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)acetamide
N-[(4-chlorobenzylidene)amino]-2-(3-keto-5-methyl-2,4-dihydropyrazol-4-yl)acetamide
N-[(4-chlorophenyl)methylideneamino]-2-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)ethanamide
ST5063681

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
Schistosoma mansoni	ap endonuclease	0.0036	0.0049	0.0242
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0562	0.0516
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0562	0.0516
Loa Loa (eye worm)	hypothetical protein	0.005	0.0245	0.1547
Trypanosoma cruzi	beta-ketoacyl-ACP reductase	0.005	0.0245	0.3819
Mycobacterium tuberculosis	Probable oxidoreductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Mycobacterium leprae	NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE)	0.0745	1	1
Mycobacterium ulcerans	3-oxoacyl-ACP reductase	0.005	0.0245	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0146	0.1584	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0562	0.0516
Plasmodium vivax	enoyl-acyl carrier protein reductase	0.0745	1	1
Toxoplasma gondii	ABC1 family protein	0.0073	0.0562	0.0516
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.005	0.0245	0.0197
Echinococcus multilocularis	muscleblind protein 1	0.0146	0.1584	0.7741
Echinococcus granulosus	geminin	0.0178	0.2032	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0562	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0073	0.0562	0.3549
Mycobacterium ulcerans	3-alpha-hydroxysteroid dehydrogenase	0.005	0.0245	0.0197
Echinococcus multilocularis	muscleblind protein	0.0146	0.1584	0.7741
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Mycobacterium ulcerans	lipase LipD	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	Possible oxidoreductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	esterase/lipase LipP	0.0073	0.0562	0.0516
Mycobacterium ulcerans	oxidoreductase	0.005	0.0245	0.0197
Leishmania major	oxidoreductase-like protein	0.005	0.0245	0.3819
Schistosoma mansoni	3-oxoacyl-[ACP] reductase	0.005	0.0245	0.1206
Echinococcus multilocularis	geminin	0.0178	0.2032	1
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.005	0.0245	0.1547
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0215	0.1355
Trypanosoma brucei	hypothetical protein, conserved	0.0073	0.0562	1
Mycobacterium tuberculosis	Probable hydrolase	0.0073	0.0562	0.0516
Plasmodium falciparum	enoyl-acyl carrier reductase	0.0745	1	1
Toxoplasma gondii	2,4-dienoyl CoA reductase 2, peroxisomal family protein	0.005	0.0245	0.0197
Trichomonas vaginalis	hypothetical protein	0.0745	1	1
Brugia malayi	beta-lactamase family protein	0.0073	0.0562	0.3549
Mycobacterium tuberculosis	Possible oxidoreductase	0.005	0.0245	0.0197
Mycobacterium tuberculosis	Probable esterase LipL	0.0073	0.0562	0.0516
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0562	0.0516
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0036	0.0049	0.5
Onchocerca volvulus		0.0073	0.0562	1
Leishmania major	3-oxoacyl-ACP reductase, putative	0.005	0.0245	0.3819
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Mycobacterium tuberculosis	Probable lipase LipE	0.0073	0.0562	0.0516
Brugia malayi	Muscleblind-like protein	0.0146	0.1584	1
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Brugia malayi	beta-lactamase	0.0073	0.0562	0.3549
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0562	0.0516
Mycobacterium ulcerans	20-beta-hydroxysteroid dehydrogenase FabG3	0.005	0.0245	0.0197
Toxoplasma gondii	enoyl-acyl carrier reductase ENR	0.0745	1	1
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase)	0.0745	1	1
Mycobacterium ulcerans	beta-lactamase	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.005	0.0245	0.0197
Schistosoma mansoni	dihydropteridine reductase	0.005	0.0245	0.1206
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Loa Loa (eye worm)	retinol dehydrogenase 12	0.005	0.0245	0.1547
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0073	0.0562	0.0516
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0215	0.1355
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Mycobacterium leprae	conserved hypothetical protein	0.0073	0.0562	0.0325
Mycobacterium leprae	Probable lipase LipE	0.0073	0.0562	0.0325
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.005	0.0245	0.3819
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0562	0.2767
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Echinococcus granulosus	muscleblind protein	0.0146	0.1584	0.7741
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0562	0.0516
Trypanosoma cruzi	beta-ketoacyl-ACP reductase	0.005	0.0245	0.3819
Schistosoma mansoni	hypothetical protein	0.0178	0.2032	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0073	0.0562	0.3549
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0036	0.0049	0.5
Trichomonas vaginalis	esterase, putative	0.0073	0.0562	0.0516
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0215	0.1355
Mycobacterium ulcerans	3-oxoacyl-ACP reductase	0.005	0.0245	0.0197
Plasmodium vivax	3-oxoacyl-[acyl-carrier-protein] reductase, putative	0.005	0.0245	0.0197
Mycobacterium ulcerans	hypothetical protein	0.0073	0.0562	0.0516
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0036	0.0049	0.031
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0073	0.0562	0.0516
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0562	1
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0466	0.609	0.6071
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.005	0.0245	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Leishmania major	pteridine reductase 1	0.005	0.0245	0.3819
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0562	0.2767
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Leishmania major	dehydrogenase/oxidoreductase-like protein	0.005	0.0245	0.3819
Onchocerca volvulus		0.0073	0.0562	1
Loa Loa (eye worm)	oxidoreductase	0.005	0.0245	0.1547
Echinococcus granulosus	3 oxoacyl acyl carrier protein reductase	0.005	0.0245	0.0988
Mycobacterium tuberculosis	Probable lipase LipD	0.0073	0.0562	0.0516
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.005	0.0245	0.1547
Brugia malayi	beta-lactamase family protein	0.0073	0.0562	0.3549
Leishmania major	dehydrogenase/oxidoreductase-like protein	0.005	0.0245	0.3819
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Leishmania major	hypothetical protein, conserved	0.0073	0.0562	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0146	0.1584	1
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0073	0.0562	0.0516
Entamoeba histolytica	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.005	0.0245	1
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.005	0.0245	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0562	0.3549
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.005	0.0245	0.1547
Toxoplasma gondii	3-ketoacyl-(acyl-carrier-protein) reductase	0.005	0.0245	0.0197
Echinococcus granulosus	beta LACTamase domain containing family member	0.0073	0.0562	0.2588
Mycobacterium ulcerans	short chain dehydrogenase	0.005	0.0245	0.0197
Schistosoma mansoni	hypothetical protein	0.0178	0.2032	1
Wolbachia endosymbiont of Brugia malayi	enoyl-ACP reductase	0.0745	1	1
Onchocerca volvulus		0.0073	0.0562	1
Mycobacterium tuberculosis	Probable 3-oxoacyl-[acyl-carrier protein] reductase FabG2 (3-ketoacyl-acyl carrier protein reductase)	0.005	0.0245	0.0197
Trypanosoma brucei	beta-ketoacyl-ACP reductase	0.005	0.0245	0.3819
Mycobacterium tuberculosis	Possible 20-beta-hydroxysteroid dehydrogenase FabG3 (cortisone reductase) ((R)-20-hydroxysteroid dehydrogenase)	0.005	0.0245	0.0197
Toxoplasma gondii	short chain dehydrogenase family protein, putative	0.005	0.0245	0.0197
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Wolbachia endosymbiont of Brugia malayi	Short-chain alcohol dehydrogenase family enzyme	0.005	0.0245	0.0197
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0073	0.0562	0.2588
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0215	0.1355
Trypanosoma brucei	oxidoreductase-like protein	0.005	0.0245	0.3819
Echinococcus multilocularis	3 oxoacyl acyl carrier protein reductase	0.005	0.0245	0.0988
Plasmodium vivax	hypothetical protein, conserved	0.0073	0.0562	0.0516
Mycobacterium ulcerans	enoyl-(acyl carrier protein) reductase	0.0745	1	1
Trypanosoma brucei	pteridine reductase 1	0.005	0.0245	0.3819
Schistosoma mansoni	ap endonuclease	0.0036	0.0049	0.0242
Loa Loa (eye worm)	beta-lactamase	0.0073	0.0562	0.3549
Plasmodium falciparum	3-oxoacyl-[acyl-carrier-protein] reductase	0.005	0.0245	0.0197
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.005	0.0245	0.0197
Brugia malayi	exodeoxyribonuclease III family protein	0.0036	0.0049	0.031

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 657170