Detailed information for compound 876512

Basic information

Technical information
  • TDR Targets ID: 876512
  • Name: N-(2,4-dibromophenyl)-4-pyridin-2-ylpiperazin e-1-carboxamide
  • MW: 440.132 | Formula: C16H16Br2N4O
  • H donors: 1 H acceptors: 2 LogP: 3.35 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(c(c1)Br)NC(=O)N1CCN(CC1)c1ccccn1
  • InChi: 1S/C16H16Br2N4O/c17-12-4-5-14(13(18)11-12)20-16(23)22-9-7-21(8-10-22)15-3-1-2-6-19-15/h1-6,11H,7-10H2,(H,20,23)
  • InChiKey: VTLDFSXJKJVZEQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2,4-dibromophenyl)-4-(2-pyridyl)piperazine-1-carboxamide
  • N-(2,4-dibromophenyl)-4-(2-pyridyl)-1-piperazinecarboxamide
  • N-(2,4-dibromophenyl)-4-pyridin-2-yl-piperazine-1-carboxamide
  • Oprea1_644931

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
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.101 0.7149 1
Onchocerca volvulus 0.0049 0.0239 0.0946
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0039 0.0321
Brugia malayi Pax transcription factor protein 2 0.0238 0.1597 0.7423
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.002 0.0028 0.5
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0205 0.0898
Onchocerca volvulus 0.0026 0.0073 0.016
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.002 0.0029 0.0106
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0039 0.0182
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0039 0.0182
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0073 0.016
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0039 0.0182
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0039 0.0321
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.0757 0.3518
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0039 0.0182
Echinococcus granulosus peroxidasin 0.0026 0.0073 0.0319
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0242 0.1124
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.0757 0.3518
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0039 0.0182
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0205 0.168
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0073 0.0339
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0242 0.1124
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.013 0.0603
Echinococcus granulosus tumor protein p63 0.0334 0.2288 1
Echinococcus multilocularis tumor protein p63 0.0334 0.2288 1
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0039 0.0182
Schistosoma mansoni peroxidasin 0.0026 0.0073 0.0597
Loa Loa (eye worm) hypothetical protein 0.0315 0.2152 1
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0039 0.0171
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Onchocerca volvulus 0.0315 0.2152 1
Onchocerca volvulus 0.0026 0.0073 0.016
Brugia malayi steroid hormone receptor 0.0021 0.0039 0.0182
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0205 0.0955
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0205 0.168
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0039 0.0321
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0 0.5
Echinococcus multilocularis peroxidasin 0.0026 0.0073 0.0319
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.101 0.7149 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0073 0.0339
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0039 0.0321
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0039 0.0171
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.002 0.0028 0.5
Brugia malayi Peroxidasin 0.0026 0.0073 0.0339
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0039 0.0321
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0039 0.0321
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0039 0.0171
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0073 0.0339
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0039 0.0182
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0039 0.0182
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1407 1 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0039 0.0171
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0039 0.0171
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.002 0.0028 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0205 0.168
Loa Loa (eye worm) blistered cuticle protein 3 0.0026 0.0073 0.0339
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0039 0.0321
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0073 0.0339
Onchocerca volvulus Peroxidase homolog 0.0026 0.0073 0.016
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0039 0.0171
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0397 0.2739 1
Brugia malayi nuclear receptor NHR-88 0.0021 0.0039 0.0182
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0073 0.0339
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi nuclear hormone receptor 0.0021 0.0039 0.0182
Brugia malayi Blistered cuticle protein 3 0.0026 0.0073 0.0339
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0039 0.0321
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0039 0.0182
Giardia lamblia Myb 1-like protein 0.002 0.0029 0.5
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0039 0.0171
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0039 0.0182
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1407 1 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0 0.5
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0039 0.0171
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.0029 1
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0205 0.0898
Brugia malayi hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Schistosoma mansoni coup transcription factor 0.0021 0.0039 0.0321
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.0239 0.1955
Onchocerca volvulus Chorion peroxidase homolog 0.0026 0.0073 0.016
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0049 0.0239 0.1111
Brugia malayi hypothetical protein 0.0315 0.2152 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0 0.5
Onchocerca volvulus 0.0238 0.1597 0.7375
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0039 0.0321
Schistosoma mansoni hypothetical protein 0.0186 0.1223 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0039 0.0182
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0205 0.0955
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0039 0.0182
Echinococcus multilocularis thyroid hormone receptor alpha 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.002 0.0028 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0039 0.0182
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi MH2 domain containing protein 0.0121 0.0757 0.3518
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0039 0.0171
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1407 1 0.5
Echinococcus granulosus geminin 0.0186 0.1223 0.5346
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Loa Loa (eye worm) pax transcription factor protein 2 0.0238 0.1597 0.7423
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0205 0.0898
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0049 0.0242 0.1124
Onchocerca volvulus 0.0026 0.0073 0.016
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0242 0.1124
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0073 0.0339
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0039 0.0321
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Onchocerca volvulus Peroxidase homolog 0.0026 0.0073 0.016
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0205 0.0898
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Brugia malayi ecdysteroid receptor 0.0021 0.0039 0.0182
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0073 0.0339
Schistosoma mansoni hypothetical protein 0.0186 0.1223 1
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.0029 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0034 0.013 0.0603
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.002 0.0028 0.5
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0073 0.0339
Schistosoma mansoni hypothetical protein 0.0034 0.013 0.1062
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0039 0.0321
Onchocerca volvulus Dual oxidase homolog 0.0026 0.0073 0.016
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0039 0.0321
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0 0.5
Echinococcus multilocularis geminin 0.0186 0.1223 0.5346
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0039 0.0171
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0073 0.016
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0016 0 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0039 0.0182
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0039 0.0182
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0073 0.0339
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0039 0.0182
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0039 0.0182
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0039 0.0171
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Schistosoma mansoni peroxidasin 0.0026 0.0073 0.0597
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0039 0.0171
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0039 0.0182
Trichomonas vaginalis MYB, putative 0.002 0.0029 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0039 0.0182
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0021 0.0039 0.0182
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0339
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0039 0.0171

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

Bibliographic References

No literature references available for this target.

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