Detailed information for compound 847094

Basic information

Technical information
  • TDR Targets ID: 847094
  • Name: N-(4-chlorophenyl)-1-(2,4-dimethylphenyl)-5-m ethyltriazole-4-carboxamide
  • MW: 340.807 | Formula: C18H17ClN4O
  • H donors: 1 H acceptors: 3 LogP: 4.27 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)NC(=O)c1nnn(c1C)c1ccc(cc1C)C
  • InChi: 1S/C18H17ClN4O/c1-11-4-9-16(12(2)10-11)23-13(3)17(21-22-23)18(24)20-15-7-5-14(19)6-8-15/h4-10H,1-3H3,(H,20,24)
  • InChiKey: GEJWZEMIIIYBJG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-chlorophenyl)-1-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide
  • N-(4-chlorophenyl)-1-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxamide
  • N-(4-chlorophenyl)-1-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxamide
  • ZINC02699055

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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0066 0.0818 0.0818
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0066 0.0818 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.0043 0.0414 0.0414
Onchocerca volvulus Peroxidase homolog 0.0233 0.3818 1
Loa Loa (eye worm) animal heme peroxidase 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0171 0.0447
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0066 0.0818 1
Brugia malayi Animal haem peroxidase family protein 0.0233 0.3818 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0043 0.0414 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0038 0.0331 0.0331
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0066 0.0818 1
Onchocerca volvulus Peroxidase homolog 0.0233 0.3818 1
Schistosoma mansoni hypothetical protein 0.0029 0.0171 0.0171
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Brugia malayi Animal haem peroxidase family protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Brugia malayi Peroxidasin 0.0233 0.3818 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0038 0.0331 0.0331
Loa Loa (eye worm) hypothetical protein 0.0066 0.0818 0.2143
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0038 0.0331 0.0331
Brugia malayi hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0038 0.0331 0.0868
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0038 0.0331 0.0331
Echinococcus multilocularis peroxidasin 0.0233 0.3818 0.3818
Loa Loa (eye worm) cytochrome P450 family protein 0.0041 0.0377 0.0987
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0038 0.0331 0.0331
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0233 0.3818 1
Loa Loa (eye worm) animal heme peroxidase 0.0233 0.3818 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0038 0.0331 0.0868
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0038 0.0331 0.0331
Echinococcus granulosus peptidase Clp S14 family 0.0043 0.0414 0.0414
Loa Loa (eye worm) hypothetical protein 0.0043 0.0414 0.1085
Brugia malayi MH2 domain containing protein 0.01 0.1436 0.3762
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) animal heme peroxidase 0.0233 0.3818 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 0.5
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0043 0.0414 0.5
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 0.5
Brugia malayi Probable ClpP-like protease 0.0066 0.0818 0.2143
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0043 0.0414 0.1085
Onchocerca volvulus 0.0233 0.3818 1
Onchocerca volvulus Peroxidasin homolog 0.0233 0.3818 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0043 0.0414 0.1085
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Onchocerca volvulus 0.0233 0.3818 1
Brugia malayi Animal haem peroxidase family protein 0.0233 0.3818 1
Brugia malayi Animal haem peroxidase family protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Brugia malayi latrophilin 2 splice variant baaae 0.0029 0.0171 0.0447
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0066 0.0818 0.0818
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0038 0.0331 0.0331
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0043 0.0414 0.4744
Onchocerca volvulus Peroxidasin homolog 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) animal heme peroxidase 0.0233 0.3818 1
Schistosoma mansoni peptidase Clp (S14 family) 0.0066 0.0818 0.0818
Onchocerca volvulus Chorion peroxidase homolog 0.0233 0.3818 1
Schistosoma mansoni peroxidasin 0.0233 0.3818 0.3818
Toxoplasma gondii hypothetical protein 0.0023 0.0049 0.06
Brugia malayi Blistered cuticle protein 3 0.0233 0.3818 1
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 0.5
Brugia malayi Cytochrome P450 family protein 0.0041 0.0377 0.0987
Schistosoma mansoni microtubule-associated protein tau 0.0578 1 1
Brugia malayi Animal haem peroxidase family protein 0.0233 0.3818 1
Echinococcus granulosus peroxidasin 0.0233 0.3818 0.3818
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0066 0.0818 1
Echinococcus multilocularis microtubule associated protein 2 0.0578 1 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0066 0.0818 0.5
Onchocerca volvulus 0.0233 0.3818 1
Loa Loa (eye worm) transcription factor SMAD2 0.01 0.1436 0.3762
Brugia malayi Calcitonin receptor-like protein seb-1 0.0043 0.0414 0.1085
Giardia lamblia High cysteine protein 0.002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0233 0.3818 1
Schistosoma mansoni peroxidasin 0.0233 0.3818 0.3818
Onchocerca volvulus Dual oxidase homolog 0.0233 0.3818 1
Loa Loa (eye worm) MH2 domain-containing protein 0.01 0.1436 0.3762

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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