Detailed information for compound 1368807

Basic information

Technical information
  • TDR Targets ID: 1368807
  • Name: N-(4-ethoxyphenyl)-3-(tetrazol-1-yl)benzamide
  • MW: 309.323 | Formula: C16H15N5O2
  • H donors: 1 H acceptors: 4 LogP: 2.4 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1)NC(=O)c1cccc(c1)n1cnnn1
  • InChi: 1S/C16H15N5O2/c1-2-23-15-8-6-13(7-9-15)18-16(22)12-4-3-5-14(10-12)21-11-17-19-20-21/h3-11H,2H2,1H3,(H,18,22)
  • InChiKey: VVPJCJGCWALLMO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-ethoxyphenyl)-3-(1-tetrazolyl)benzamide
  • N-(4-ethoxyphenyl)-3-(1,2,3,4-tetrazol-1-yl)benzamide
  • ZINC00418368
  • Oprea1_301833
  • MLS000033422
  • N-(4-Ethoxy-phenyl)-3-tetrazol-1-yl-benzamide
  • SMR000002251
  • ASN 03365873

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ubiquitin specific peptidase 2 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum expressed protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei gambiense ubiquitin carboxyl-terminal hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum ko:K01072 ubiquitin thiolesterase [EC3.1.2.15], putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR001394,Peptidase C19, ubiquitin carboxyl-terminal hydrolase 2,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium parvum ubiquitin C-terminal hydrolase of the cysteine proteinase fold Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Cryptosporidium hominis ubiquitin specific protease 66 Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania mexicana ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma congolense ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania donovani ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania infantum ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR015063,Domain of unknown function DUF1873,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania braziliensis ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans ubiquitin-specific protease Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ubiquitin specific protease, putative ubiquitin specific peptidase 2 362 aa 378 aa 25.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis CMGC family protein kinase 0.0043 0.0771 0.862
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0045 0.0894 1
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0894 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0048 0.1101 1
Brugia malayi RNA binding protein 0.0076 0.2854 1
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0043 0.0771 1
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0045 0.0894 0.3132
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0048 0.1101 1
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0043 0.0771 0.862
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0894 1
Trypanosoma brucei protein kinase, putative 0.0043 0.0771 0.862
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0045 0.0894 0.8119
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0045 0.0894 0.3132
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.2854 1
Schistosoma mansoni hypothetical protein 0.0043 0.0819 0.2871
Loa Loa (eye worm) RNA binding protein 0.0076 0.2854 1
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0043 0.0771 0.6998
Onchocerca volvulus 0.003 0 0.5
Mycobacterium leprae conserved hypothetical protein 0.003 0 0.5
Brugia malayi hypothetical protein 0.0043 0.0819 0.2871
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0894 0.3132
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0043 0.0771 0.862
Onchocerca volvulus 0.003 0 0.5
Trichomonas vaginalis CMGC family protein kinase 0.0043 0.0771 0.862
Trichomonas vaginalis CMGC family protein kinase 0.0043 0.0771 0.862
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0894 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.2854 1
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0043 0.0771 0.862
Trichomonas vaginalis CMGC family protein kinase 0.0043 0.0771 0.862
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0819 0.2871
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0043 0.0771 0.862
Loa Loa (eye worm) hypothetical protein 0.0045 0.0894 0.3132
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0043 0.0771 0.6998
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0043 0.0771 0.27
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0045 0.0894 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2854 1
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0894 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2854 1
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0048 0.1101 1
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0894 0.3132
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0894 0.3132
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0819 0.2871
Mycobacterium leprae Probable lipase LipE 0.003 0 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0043 0.0771 0.27
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0894 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2854 1
Brugia malayi TAR-binding protein 0.0076 0.2854 1
Plasmodium vivax hypothetical protein, conserved 0.003 0 0.5
Onchocerca volvulus 0.003 0 0.5
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0045 0.0894 0.3132
Echinococcus granulosus ubiquitin specific protease 41 0.0045 0.0894 0.3132
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0048 0.1101 0.3857
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2854 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0043 0.0771 0.27
Echinococcus granulosus tar DNA binding protein 0.0076 0.2854 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0048 0.1101 0.1101
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0043 0.0771 0.862
Echinococcus multilocularis mitogen activated protein kinase 0.0043 0.0771 0.27
Echinococcus multilocularis mitogen activated protein kinase 3 0.0043 0.0771 0.27
Loa Loa (eye worm) TAR-binding protein 0.0076 0.2854 1
Brugia malayi MAP kinase sur-1 0.0043 0.0771 0.27
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0894 0.3132
Echinococcus multilocularis ubiquitin specific protease 41 0.0045 0.0894 0.3132
Echinococcus multilocularis tar DNA binding protein 0.0076 0.2854 1
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0045 0.0902 0.316
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2854 1
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0048 0.1101 0.3857
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0048 0.1101 0.3857
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0894 1
Echinococcus granulosus mitogen activated protein kinase 0.0043 0.0771 0.27
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0819 0.2871
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0048 0.1101 0.3857

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 2.3109 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a Using CHOP2 as the Reporter. (Class of assay: confirmatory) [Related pubchem assays: 2281 (Summary of qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a), 463106 (LOPAC Validation Assay for Inhibitors of Ubiquitin-specific Protease USP2a)] ChEMBL. No reference
Potency (functional) 15.8489 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference

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

Bibliographic References

No literature references available for this target.

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