TDR Targets

Basic information

Technical information

TDR Targets ID: 881695
Name: 2-[1-[2-(2-chlorophenyl)acetyl]piperidin-4-yl ]-N-[3-(2-methylpropoxy)propyl]-1,3-thiazole- 4-carboxamide
MW: 478.047 | Formula: C24H32ClN3O3S
H donors: 1 H acceptors: 3 LogP: 4.4 Rotable bonds: 12
Rule of 5 violations (Lipinski): 1
SMILES: CC(COCCCNC(=O)c1csc(n1)C1CCN(CC1)C(=O)Cc1ccccc1Cl)C
InChi: 1S/C24H32ClN3O3S/c1-17(2)15-31-13-5-10-26-23(30)21-16-32-24(27-21)18-8-11-28(12-9-18)22(29)14-19-6-3-4-7-20(19)25/h3-4,6-7,16-18H,5,8-15H2,1-2H3,(H,26,30)
InChiKey: OIWWEAVXTHRGGR-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-[1-[2-(2-chlorophenyl)acetyl]-4-piperidyl]-N-(3-isobutoxypropyl)thiazole-4-carboxamide
2-[1-[2-(2-chlorophenyl)-1-oxoethyl]-4-piperidinyl]-N-(3-isobutoxypropyl)-4-thiazolecarboxamide
2-[1-[2-(2-chlorophenyl)ethanoyl]piperidin-4-yl]-N-[3-(2-methylpropoxy)propyl]-1,3-thiazole-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
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0738	1	1
Echinococcus granulosus	hexokinase type 2	0.0077	0.0724	0.0724
Echinococcus granulosus	citrate lyase subunit beta protein	0.0029	0.0041	0.0041
Toxoplasma gondii	glucose-6-phosphate 1-dehydrogenase	0.0483	0.6422	1
Echinococcus multilocularis	hexokinase type 2	0.0077	0.0724	0.0724
Brugia malayi	hypothetical protein	0.0176	0.2118	0.2197
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Brugia malayi	protein kinase C3,putative	0.0026	0.0009	0.001
Schistosoma mansoni	hypothetical protein	0.0033	0.0103	0.0103
Leishmania major	glucose-6-phosphate 1-dehydrogenase, putative	0.0465	0.6173	1
Entamoeba histolytica	hypothetical protein	0.0035	0.0129	0.052
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0202	0.2475	0.2475
Schistosoma mansoni	unc-13 (munc13)	0.0028	0.0026	0.0026
Trichomonas vaginalis	mannose-6-phosphate isomerase, putative	0.0094	0.0963	0.1446
Loa Loa (eye worm)	RNA binding protein	0.0135	0.1541	0.1549
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0026	0.0009	0.0009
Echinococcus granulosus	glucose 6 phosphate 1 dehydrogenase	0.0465	0.6173	0.6173
Entamoeba histolytica	hexokinase 2	0.0077	0.0724	0.2924
Schistosoma mansoni	tar DNA-binding protein	0.0135	0.1541	0.1541
Schistosoma mansoni	hexokinase	0.0077	0.0724	0.0724
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0129	0.0129
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Schistosoma mansoni	atypical protein kinase C	0.0026	0.0009	0.0009
Trypanosoma cruzi	hypothetical protein, conserved	0.0248	0.3129	0.5036
Schistosoma mansoni	serine/threonine protein kinase	0.0026	0.0009	0.0009
Brugia malayi	glutaminase DH11.1	0.0319	0.4123	0.4278
Loa Loa (eye worm)	TKL/RAF/RAF protein kinase	0.0418	0.5513	0.5541
Loa Loa (eye worm)	raf kinase	0.0734	0.9949	1
Mycobacterium tuberculosis	Probable mannose-6-phosphate isomerase ManA (phosphomannose isomerase) (phosphomannoisomerase) (PMI) (phosphohexoisomerase) (pho	0.0051	0.0357	0.1696
Echinococcus multilocularis	glucose 6 phosphate 1 dehydrogenase	0.0465	0.6173	0.6173
Trichomonas vaginalis	6-phosphogluconolactonase, putative	0.0483	0.6422	1
Echinococcus granulosus	tar DNA binding protein	0.0135	0.1541	0.1541
Onchocerca volvulus	Hexokinase homolog	0.0048	0.0319	0.1291
Trypanosoma cruzi	polo-like protein kinase, putative	0.0202	0.2475	0.397
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0318	0.033
Brugia malayi	glucose-6-phosphate dehydrogenase	0.0465	0.6173	0.6404
Trypanosoma cruzi	polo-like protein kinase, putative	0.0202	0.2475	0.397
Schistosoma mansoni	mannose-6-phosphate isomerase	0.0094	0.0963	0.0963
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Trypanosoma brucei	polo-like protein kinase	0.0202	0.2475	0.3214
Loa Loa (eye worm)	hexokinase	0.0077	0.0724	0.0728
Echinococcus multilocularis	hexokinase	0.0077	0.0724	0.0724
Schistosoma mansoni	serine/threonine protein kinase	0.0026	0.0009	0.0009
Entamoeba histolytica	hexokinase 1	0.0077	0.0724	0.2924
Entamoeba histolytica	hypothetical protein	0.0035	0.0129	0.052
Toxoplasma gondii	phosphomannose isomerase type I protein	0.0094	0.0963	0.15
Loa Loa (eye worm)	glutaminase	0.0319	0.4123	0.4144
Trypanosoma cruzi	glucose-6-phosphate 1-dehydrogenase, putative	0.0465	0.6173	1
Mycobacterium ulcerans	mannose-6-phosphate isomerase ManA	0.0094	0.0963	0.1505
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0129	0.0129
Loa Loa (eye worm)	transcription factor SMAD2	0.0116	0.1265	0.1272
Echinococcus multilocularis	hexokinase	0.0077	0.0724	0.0724
Echinococcus granulosus	mannose 6 phosphate isomerase	0.0094	0.0963	0.0963
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0135	0.1541	0.1549
Giardia lamblia	Glucose-6-phosphate 1-dehydrogenase	0.0483	0.6422	1
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.0026	0.0009	0.0009
Brugia malayi	TAR-binding protein	0.0135	0.1541	0.1599
Chlamydia trachomatis	glucose-6-phosphate 1-dehydrogenase	0.0465	0.6173	0.5
Brugia malayi	protein kinase C II.	0.0026	0.0009	0.001
Brugia malayi	Phorbol esters/diacylglycerol binding domain	0.0026	0.0009	0.001
Echinococcus multilocularis	mannose 6 phosphate isomerase	0.0094	0.0963	0.0963
Brugia malayi	hexokinase	0.0077	0.0724	0.0751
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0026	0.0009	0.0009
Mycobacterium ulcerans	glucose-6-phosphate 1-dehydrogenase	0.0304	0.3906	0.6304
Brugia malayi	Hexokinase family protein	0.0048	0.0319	0.0331
Loa Loa (eye worm)	glucose-6-phosphate dehydrogenase	0.0465	0.6173	0.6204
Toxoplasma gondii	hexokinase	0.0077	0.0724	0.1127
Mycobacterium tuberculosis	Probable glucose-6-phosphate 1-dehydrogenase Zwf2 (G6PD)	0.0161	0.1905	1
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.0026	0.0009	0.0009
Trichomonas vaginalis	glucosamine-6-phosphate isomerase, putative	0.0483	0.6422	1
Loa Loa (eye worm)	TAR-binding protein	0.0135	0.1541	0.1549
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Brugia malayi	C1-like domain containing protein	0.0026	0.0009	0.001
Entamoeba histolytica	hypothetical protein	0.0035	0.0129	0.052
Trypanosoma cruzi	hexokinase, putative	0.0077	0.0724	0.1114
Schistosoma mansoni	tar DNA-binding protein	0.0135	0.1541	0.1541
Schistosoma mansoni	tar DNA-binding protein	0.0135	0.1541	0.1541
Schistosoma mansoni	serine/threonine protein kinase	0.0026	0.0009	0.0009
Brugia malayi	Protein kinase domain containing protein	0.0026	0.0009	0.001
Echinococcus multilocularis	tar DNA binding protein	0.0135	0.1541	0.1541
Trichomonas vaginalis	glucosamine-6-phosphate isomerase, putative	0.0483	0.6422	1
Trypanosoma brucei	hypothetical protein, conserved	0.0248	0.3129	0.4413
Leishmania major	phosphomannose isomerase	0.0094	0.0963	0.1505
Onchocerca volvulus		0.0077	0.0724	0.2924
Brugia malayi	Protein kinase c protein 2	0.0026	0.0009	0.001
Brugia malayi	serine/threonine-protein kinase plk-2	0.0202	0.2475	0.2568
Onchocerca volvulus		0.0048	0.0319	0.1291
Schistosoma mansoni	serine/threonine protein kinase	0.0202	0.2475	0.2475
Schistosoma mansoni	glucose-6-phosphate 1-dehydrogenase	0.0465	0.6173	0.6173
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0202	0.2475	1
Schistosoma mansoni	serine/threonine protein kinase	0.0026	0.0009	0.0009
Onchocerca volvulus		0.0077	0.0724	0.2924
Mycobacterium ulcerans	glutaminase	0.0319	0.4123	0.6658
Brugia malayi	RNA recognition motif domain containing protein	0.0135	0.1541	0.1599
Brugia malayi	Raf kinase	0.0712	0.9639	1
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Entamoeba histolytica	mannose-6-phosphate isomerase, putative	0.0043	0.0245	0.0991
Schistosoma mansoni	tar DNA-binding protein	0.0135	0.1541	0.1541
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0379	0.0381
Schistosoma mansoni	kinase	0.0103	0.108	0.108
Echinococcus multilocularis	hexokinase	0.0077	0.0724	0.0724
Loa Loa (eye worm)	mannose-6-phosphate isomerase	0.0094	0.0963	0.0968
Onchocerca volvulus		0.0176	0.2118	0.8555
Loa Loa (eye worm)	mannose-6-phosphate isomerase	0.0094	0.0963	0.0968
Mycobacterium ulcerans	glucose-6-phosphate 1-dehydrogenase	0.0465	0.6173	1
Brugia malayi	RNA binding protein	0.0135	0.1541	0.1599
Trichomonas vaginalis	CAMK family protein kinase	0.01	0.1043	0.1571
Echinococcus granulosus	hexokinase	0.0077	0.0724	0.0724
Loa Loa (eye worm)	hypothetical protein	0.0176	0.2118	0.2128
Loa Loa (eye worm)	hexokinase	0.0077	0.0724	0.0728
Loa Loa (eye worm)	glutaminase 2	0.0319	0.4123	0.4144
Schistosoma mansoni	tar DNA-binding protein	0.0135	0.1541	0.1541
Brugia malayi	hypothetical protein	0.0035	0.0129	0.0134
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0202	0.2475	1
Echinococcus multilocularis	protein kinase c epsilon type	0.0026	0.0009	0.0009
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0318	0.0319
Echinococcus granulosus	Protein kinase C brain isozyme	0.0026	0.0009	0.0009
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Echinococcus granulosus	hexokinase	0.0077	0.0724	0.0724
Plasmodium vivax	glucose-6-phosphate 1-dehydrogenase, putative	0.0483	0.6422	1
Schistosoma mansoni	protein kinase C mu	0.0026	0.0009	0.0009
Loa Loa (eye worm)	MH2 domain-containing protein	0.0116	0.1265	0.1272
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0202	0.2475	0.397
Schistosoma mansoni	serine/threonine protein kinase	0.0026	0.0009	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0318	0.0319
Echinococcus multilocularis	protein kinase c iota type	0.0026	0.0009	0.0009
Trypanosoma cruzi	Glucose-6-phosphate dehydrogenase, putative	0.015	0.1741	0.2773
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0103	0.0107
Treponema pallidum	glucose-6-phosphate 1-dehydrogenase	0.0465	0.6173	1
Trypanosoma cruzi	hexokinase, putative	0.0077	0.0724	0.1114
Entamoeba histolytica	hypothetical protein	0.0035	0.0129	0.052
Brugia malayi	Hexokinase family protein	0.0077	0.0724	0.0751
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0103	0.0103
Leishmania major	hypothetical protein, conserved	0.0248	0.3129	0.5036
Trichomonas vaginalis	CAMK family protein kinase	0.0202	0.2475	0.3815
Brugia malayi	mannose-6-phosphate isomerase, class I family protein	0.0094	0.0963	0.1
Brugia malayi	mannose-6-phosphate isomerase, class I family protein	0.0094	0.0963	0.1
Trypanosoma cruzi	glucose-6-phosphate 1-dehydrogenase, putative	0.0154	0.1804	0.2875
Mycobacterium leprae	probable mannose-6-phosphate isomerase ManA (PHOSPHOMANNOSE ISOMERASE) (PHOSPHOMANNOISOMERASE) (PMI) (PHOSPHOHEXOISOMERASE) (PHO	0.0051	0.0357	0.5
Echinococcus granulosus	protein kinase c epsilon type	0.0026	0.0009	0.0009
Entamoeba histolytica	phosphomannose isomerase, putative	0.0094	0.0963	0.3892
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0129	0.0129
Toxoplasma gondii	glucose-6-phosphate 1-dehydrogenase	0.0304	0.3906	0.6082
Plasmodium falciparum	mannose-6-phosphate isomerase, putative	0.0094	0.0963	0.0421
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0318	0.033
Echinococcus multilocularis	citrate lyase subunit beta protein	0.0029	0.0041	0.0041
Trichomonas vaginalis	CAMK family protein kinase	0.01	0.1043	0.1571
Plasmodium vivax	mannose-6-phosphate isomerase, putative	0.0094	0.0963	0.0421
Schistosoma mansoni	glutaminase	0.0319	0.4123	0.4123
Plasmodium falciparum	glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase	0.0483	0.6422	1
Trichomonas vaginalis	glutaminase, putative	0.0319	0.4123	0.6398
Brugia malayi	MH2 domain containing protein	0.0116	0.1265	0.1313
Trypanosoma brucei	glucose-6-phosphate 1-dehydrogenase	0.0465	0.6173	1
Schistosoma mansoni	serine/threonine protein kinase	0.0738	1	1
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0202	0.2475	0.2475
Trypanosoma cruzi	phosphomannose isomerase, putative	0.0094	0.0963	0.1505
Echinococcus granulosus	protein kinase c iota type	0.0026	0.0009	0.0009
Trypanosoma cruzi	phosphomannose isomerase, putative	0.0094	0.0963	0.1505
Leishmania major	hexokinase, putative	0.0077	0.0724	0.1114
Onchocerca volvulus		0.0077	0.0724	0.2924
Trypanosoma brucei	phosphomannose isomerase	0.0094	0.0963	0.044
Leishmania major	hexokinase, putative	0.0077	0.0724	0.1114
Trypanosoma cruzi	hypothetical protein, conserved	0.0248	0.3129	0.5036
Schistosoma mansoni	hypothetical protein	0.0035	0.0129	0.0129
Loa Loa (eye worm)	hexokinase	0.0048	0.0319	0.0321
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0202	0.2475	0.2488
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.0026	0.0009	0.0009
Loa Loa (eye worm)	AGC/PKC/IOTA protein kinase	0.0026	0.0009	0.0009
Echinococcus granulosus	hexokinase	0.0077	0.0724	0.0724
Loa Loa (eye worm)	hexokinase type II	0.0077	0.0724	0.0728

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 881695