TDR Targets

Basic information

Technical information

TDR Targets ID: 833410
Name: N-butyl-2-(4H-chromeno[3,4-d]pyrazol-1-yl)-N- methylacetamide
MW: 299.368 | Formula: C17H21N3O2
H donors: 0 H acceptors: 2 LogP: 2.32 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCCCN(C(=O)Cn1ncc2c1c1ccccc1OC2)C
InChi: 1S/C17H21N3O2/c1-3-4-9-19(2)16(21)11-20-17-13(10-18-20)12-22-15-8-6-5-7-14(15)17/h5-8,10H,3-4,9,11-12H2,1-2H3
InChiKey: TTXACFMMDONHLE-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-butyl-2-(4H-chromeno[3,4-d]pyrazol-1-yl)-N-methyl-acetamide
N-butyl-2-(4H-chromeno[3,4-d]pyrazol-1-yl)-N-methyl-ethanamide

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
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0189	0.9587	0.9578
Loa Loa (eye worm)	hypothetical protein	0.0124	0.3544	0.3544
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Onchocerca volvulus		0.0189	0.9587	1
Brugia malayi	Cathepsin L-like precursor	0.0124	0.3544	0.3544
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0106	0.1875	0.1697
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0106	0.1875	0.1875
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0106	0.1875	0.1772
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0189	0.9587	1
Trypanosoma cruzi	cysteine protease, putative	0.0106	0.1875	0.1697
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0189	0.9587	0.9578
Onchocerca volvulus		0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0189	0.9587	0.9578
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Onchocerca volvulus		0.0189	0.9587	1
Onchocerca volvulus		0.0189	0.9587	1
Plasmodium vivax	vivapain-2	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Echinococcus granulosus	cathepsin L	0.0106	0.1875	0.1875
Entamoeba histolytica	cysteine protease, putative	0.0189	0.9587	1
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0106	0.1875	0.1875
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0106	0.1875	0.1875
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0124	0.3544	0.3544
Onchocerca volvulus		0.0189	0.9587	1
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.9587	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0189	0.9587	0.9587
Onchocerca volvulus		0.0189	0.9587	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0189	0.9587	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0106	0.1875	0.1875
Loa Loa (eye worm)	hypothetical protein	0.0189	0.9587	0.9587
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Echinococcus multilocularis	cathepsin L	0.0106	0.1875	0.1875
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Echinococcus multilocularis	cathepsin b	0.0193	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0106	0.1875	0.1772
Loa Loa (eye worm)	hypothetical protein	0.0193	1	1
Giardia lamblia	Cathepsin B precursor	0.0088	0.0214	0.5
Entamoeba histolytica	cysteine proteinase, putative	0.0124	0.3544	0.2164
Onchocerca volvulus	Cathepsin L homolog	0.0189	0.9587	1
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.9587	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0189	0.9587	0.9587
Trypanosoma cruzi	cysteine peptidase, putative	0.0106	0.1875	0.1697
Echinococcus multilocularis	cathepsin L cysteine protease	0.0189	0.9587	0.9587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Loa Loa (eye worm)	hypothetical protein	0.0124	0.3544	0.3544
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0189	0.9587	1
Echinococcus granulosus	cysteine protease	0.0106	0.1875	0.1875
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	1	1
Echinococcus multilocularis	cathepsin b	0.0193	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0189	0.9587	0.9587
Echinococcus multilocularis	cysteine protease	0.0189	0.9587	0.9587
Echinococcus multilocularis	cysteine protease	0.0189	0.9587	0.9587
Echinococcus granulosus	cathepsin b	0.0193	1	1
Giardia lamblia	Cathepsin B precursor	0.0088	0.0214	0.5
Loa Loa (eye worm)	ctsf protein	0.0189	0.9587	0.9587
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0189	0.9587	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0189	0.9587	0.9587
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0189	0.9587	0.9578
Schistosoma mansoni	cathepsin F (C01 family)	0.0189	0.9587	0.9587
Brugia malayi	Papain family cysteine protease containing protein	0.0106	0.1875	0.1875
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0124	0.3544	0.3553
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0189	0.9587	0.9587
Plasmodium vivax	vivapain-2	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Brugia malayi	Cathepsin L-like precursor	0.0124	0.3544	0.3544
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Onchocerca volvulus		0.0189	0.9587	1
Onchocerca volvulus	Cathepsin F homolog	0.0189	0.9587	1
Brugia malayi	Papain family cysteine protease containing protein	0.0106	0.1875	0.1875
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0189	0.9587	0.9587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Loa Loa (eye worm)	hypothetical protein	0.0124	0.3544	0.3544
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0106	0.1875	0.1697
Giardia lamblia	Cathepsin B precursor	0.0088	0.0214	0.5
Onchocerca volvulus		0.0124	0.3544	0.3697
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0106	0.1875	0.1772
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Echinococcus granulosus	cathepsin l1	0.0124	0.3544	0.3544
Loa Loa (eye worm)	fibroinase	0.0189	0.9587	0.9587
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0124	0.3544	0.3403
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Toxoplasma gondii	cathepsin CPL	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Schistosoma mansoni	amine GPCR	0.0165	0.7354	0.7354
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0124	0.3544	0.3544
Trypanosoma cruzi	cysteine peptidase, putative	0.0189	0.9587	0.9578
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Toxoplasma gondii	cathepsin B	0.0088	0.0214	0.0223
Brugia malayi	cathepsin L-like precursor	0.0124	0.3544	0.3544
Onchocerca volvulus	Cathepsin L homolog	0.0189	0.9587	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0088	0.0214	0.0214
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.9587	1
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Echinococcus multilocularis	cathepsin L cysteine protease	0.0189	0.9587	0.9587
Leishmania major	cathepsin L-like protease	0.0189	0.9587	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0189	0.9587	1
Brugia malayi	Cathepsin L-like precursor	0.0189	0.9587	0.9587
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0106	0.1875	0.1772
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0193	1	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0193	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0189	0.9587	0.9587
Brugia malayi	Papain family cysteine protease containing protein	0.0189	0.9587	0.9587
Echinococcus granulosus	cathepsin b	0.0193	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0124	0.3544	0.3553
Echinococcus granulosus	cathepsin l1	0.0189	0.9587	0.9587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0189	0.9587	1
Leishmania major	cysteine peptidase A (CPA)	0.0189	0.9587	1
Loa Loa (eye worm)	cathepsin B	0.0088	0.0214	0.0214
Trypanosoma cruzi	cysteine proteinase, putative	0.0106	0.1875	0.1697
Loa Loa (eye worm)	cysteine protease	0.0189	0.9587	0.9587
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	1	1

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 833410