TDR Targets

Basic information

Technical information

TDR Targets ID: 1473407
Name: 1-(2-diethylaminoethyl)-N-[(2,5-dimethoxyphen yl)methyl]benzimidazol-2-amine
MW: 382.499 | Formula: C22H30N4O2
H donors: 1 H acceptors: 1 LogP: 3.9 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCN(CCn1c(NCc2cc(OC)ccc2OC)nc2c1cccc2)CC
InChi: 1S/C22H30N4O2/c1-5-25(6-2)13-14-26-20-10-8-7-9-19(20)24-22(26)23-16-17-15-18(27-3)11-12-21(17)28-4/h7-12,15H,5-6,13-14,16H2,1-4H3,(H,23,24)
InChiKey: RUTBUUKAFBRXLT-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

1-(2-diethylaminoethyl)-N-[(2,5-dimethoxyphenyl)methyl]-2-benzimidazolamine
2-[2-[(2,5-dimethoxybenzyl)amino]benzimidazol-1-yl]ethyl-diethyl-amine
BAS 07457280
STOCK4S-26551

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
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Schistosoma mansoni	cathepsin F (C01 family)	0.0022	0.181	0.181
Entamoeba histolytica	proteasome subunit beta type 5 precursor, putative	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Toxoplasma gondii	proteasome subunit beta type, putative	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0022	0.181	0.181
Plasmodium vivax	vivapain-2	0.0022	0.181	0.181
Loa Loa (eye worm)	hypothetical protein	0.0022	0.181	0.1309
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0022	0.181	0.1309
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Schistosoma mansoni	cathepsin F (C01 family)	0.0022	0.181	0.181
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0022	0.181	0.181
Mycobacterium leprae	proteasome (beta subunit) PrcB	0.007	1	0.5
Echinococcus multilocularis	cysteine protease	0.0022	0.181	0.181
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.007	1	1
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0022	0.181	0.181
Mycobacterium ulcerans	proteasome PrcB	0.007	1	0.5
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0015	0.0576	0.0576
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Loa Loa (eye worm)	fibroinase	0.0022	0.181	0.1309
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Echinococcus multilocularis	proteasome (prosome, macropain)	0.007	1	1
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.007	1	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Loa Loa (eye worm)	ctsf protein	0.0022	0.181	0.1309
Brugia malayi	Papain family cysteine protease containing protein	0.0022	0.181	0.181
Entamoeba histolytica	cysteine proteinase, putative	0.0015	0.0576	0.0576
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Onchocerca volvulus		0.0022	0.181	1
Giardia lamblia	Proteasome subunit beta type 5 precursor	0.007	1	0.5
Plasmodium vivax	proteasome subunit beta type-5, putative	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0015	0.0576	0.0576
Onchocerca volvulus		0.0022	0.181	1
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Echinococcus multilocularis	cathepsin L cysteine protease	0.0022	0.181	0.181
Onchocerca volvulus	Cathepsin F homolog	0.0022	0.181	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.181	0.181
Onchocerca volvulus		0.0022	0.181	1
Loa Loa (eye worm)	cysteine protease	0.0022	0.181	0.1309
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0015	0.0576	0.0576
Schistosoma mansoni	proteasome catalytic subunit 3 (T01 family)	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Onchocerca volvulus	Cathepsin L homolog	0.0022	0.181	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Leishmania major	proteasome beta 5 subunit, putative	0.007	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0022	0.181	0.181
Trypanosoma cruzi	cruzipain precursor, putative	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0015	0.0576	0.0576
Echinococcus granulosus	proteasome prosome macropain	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Entamoeba histolytica	cysteine proteinase, putative	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Onchocerca volvulus		0.0022	0.181	1
Trypanosoma brucei	proteasome subunit beta type-5, putative	0.007	1	1
Mycobacterium tuberculosis	Proteasome beta subunit PrcB; assembles with alpha subunit PrcA.	0.007	1	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Onchocerca volvulus		0.0022	0.181	1
Entamoeba histolytica	cysteine protease, putative	0.0022	0.181	0.181
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.181	0.181
Echinococcus granulosus	cathepsin l1	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Onchocerca volvulus	Cathepsin L homolog	0.0022	0.181	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Plasmodium vivax	vivapain-2	0.0022	0.181	0.181
Echinococcus multilocularis	cathepsin L cysteine protease	0.0022	0.181	0.181
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0022	0.181	0.181
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0022	0.181	0.1309
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0022	0.181	0.181
Entamoeba histolytica	cysteine proteinase, putative	0.0022	0.181	0.181
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0015	0.0576	0.0576
Plasmodium falciparum	proteasome subunit beta type-5	0.007	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Echinococcus multilocularis	cysteine protease	0.0022	0.181	0.181
Brugia malayi	Cathepsin L-like precursor	0.0015	0.0576	0.0576
Onchocerca volvulus		0.0022	0.181	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0022	0.181	0.181
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.181	0.181
Brugia malayi	cathepsin L-like precursor	0.0015	0.0576	0.0576
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0022	0.181	0.181
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0022	0.181	0.181
Onchocerca volvulus		0.0022	0.181	1
Echinococcus granulosus	cathepsin l1	0.0015	0.0576	0.0576
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0022	0.181	0.181
Schistosoma mansoni	cathepsin F (C01 family)	0.0015	0.0576	0.0576

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

ChEMBL: CHEMBL1623805

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1473407