Detailed information for compound 651744

Basic information

Technical information
  • TDR Targets ID: 651744
  • Name: N-(4-diethylaminophenyl)-2-[(4-nitrobenzoyl)a mino]benzamide
  • MW: 432.472 | Formula: C24H24N4O4
  • H donors: 2 H acceptors: 4 LogP: 4.83 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(c1ccc(cc1)NC(=O)c1ccccc1NC(=O)c1ccc(cc1)[N+](=O)[O-])CC
  • InChi: 1S/C24H24N4O4/c1-3-27(4-2)19-15-11-18(12-16-19)25-24(30)21-7-5-6-8-22(21)26-23(29)17-9-13-20(14-10-17)28(31)32/h5-16H,3-4H2,1-2H3,(H,25,30)(H,26,29)
  • InChiKey: MJZDQJOYROFGSH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-diethylaminophenyl)-2-[[(4-nitrophenyl)-oxomethyl]amino]benzamide
  • N-(4-diethylaminophenyl)-2-[(4-nitrophenyl)carbonylamino]benzamide
  • Oprea1_057986
  • Oprea1_716552

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
Brugia malayi Carboxylesterase family protein 0.003 0.0223 0.0621
Brugia malayi Carboxylesterase family protein 0.003 0.0223 0.0621
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0036 0.0234
Echinococcus multilocularis acetylcholinesterase 0.018 0.2516 0.2516
Echinococcus multilocularis carboxylesterase 5A 0.018 0.2516 0.2516
Loa Loa (eye worm) carboxylesterase 0.003 0.0223 0.0526
Echinococcus multilocularis tar DNA binding protein 0.0061 0.0697 0.0697
Schistosoma mansoni microtubule-associated protein tau 0.067 1 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.003 0.0223 0.0223
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.2407 0.6706
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.003 0.0223 0.0223
Echinococcus granulosus acetylcholinesterase 0.018 0.2516 0.2516
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0116 0.1536 1
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0697 0.0697
Loa Loa (eye worm) hypothetical protein 0.018 0.2516 0.6977
Schistosoma mansoni acetylcholinesterase 0.003 0.0223 0.0223
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0697 0.0697
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0036 0.01
Brugia malayi TAR-binding protein 0.0061 0.0697 0.1942
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0036 0.01
Echinococcus granulosus acetylcholinesterase 0.018 0.2516 0.2516
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0251 0.359 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Brugia malayi Muscleblind-like protein 0.0145 0.1974 0.5499
Echinococcus multilocularis BC026374 protein (S09 family) 0.003 0.0223 0.0223
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Loa Loa (eye worm) TAR-binding protein 0.0061 0.0697 0.186
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0036 0.0784
Toxoplasma gondii exonuclease III APE 0.0018 0.0036 0.0784
Echinococcus multilocularis microtubule associated protein 2 0.067 1 1
Loa Loa (eye worm) carboxylesterase 0.003 0.0223 0.0526
Mycobacterium ulcerans carboxylesterase, LipT 0.003 0.0223 1
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Echinococcus multilocularis neuroligin 0.003 0.0223 0.0223
Echinococcus multilocularis muscleblind protein 0.0145 0.1974 0.1974
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0697 0.0697
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0036 0.01
Brugia malayi glutathione reductase 0.0046 0.0459 0.1278
Mycobacterium tuberculosis Probable dehydrogenase 0.0105 0.1358 0.8837
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0036 0.1612
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.003 0.0223 0.1451
Brugia malayi Carboxylesterase family protein 0.018 0.2516 0.7007
Loa Loa (eye worm) hypothetical protein 0.0033 0.0263 0.0638
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.0697 0.186
Brugia malayi Carboxylesterase family protein 0.003 0.0223 0.0621
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Toxoplasma gondii thioredoxin reductase 0.0046 0.0459 1
Loa Loa (eye worm) carboxylesterase 0.018 0.2516 0.6977
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Loa Loa (eye worm) thioredoxin reductase 0.0046 0.0459 0.1189
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0105 0.1358 0.8837
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0036 0.0784
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0046 0.0459 0.2985
Echinococcus granulosus neuroligin 0.003 0.0223 0.0223
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.003 0.0223 0.1451
Plasmodium vivax thioredoxin reductase, putative 0.0046 0.0459 1
Plasmodium vivax glutathione reductase, putative 0.0046 0.0459 1
Schistosoma mansoni BC026374 protein (S09 family) 0.003 0.0223 0.0223
Plasmodium falciparum glutathione reductase 0.0046 0.0459 1
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0697 0.0697
Loa Loa (eye worm) acetylcholinesterase 1 0.018 0.2516 0.6977
Schistosoma mansoni ap endonuclease 0.0018 0.0036 0.0036
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0497 0.1384
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.003 0.0223 0.0223
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Echinococcus granulosus tar DNA binding protein 0.0061 0.0697 0.0697
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0116 0.1536 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0036 1
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Leishmania major trypanothione reductase 0.0046 0.0459 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0036 0.5
Onchocerca volvulus Glucosylceramidase homolog 0.0164 0.2272 1
Trichomonas vaginalis spcc417.12 protein, putative 0.003 0.0223 0.0621
Brugia malayi Carboxylesterase family protein 0.018 0.2516 0.7007
Echinococcus multilocularis muscleblind protein 1 0.0145 0.1974 0.1974
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0036 0.0784
Schistosoma mansoni hypothetical protein 0.0033 0.0263 0.0263
Loa Loa (eye worm) RNA binding protein 0.0061 0.0697 0.186
Echinococcus granulosus thioredoxin glutathione reductase 0.0046 0.0459 0.0459
Loa Loa (eye worm) hypothetical protein 0.018 0.2516 0.6977
Schistosoma mansoni neuroligin 3 (S09 family) 0.003 0.0223 0.0223
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.003 0.0223 0.0223
Loa Loa (eye worm) hypothetical protein 0.0145 0.1974 0.5453
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0036 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0105 0.1358 0.8837
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0036 0.0784
Brugia malayi hypothetical protein 0.003 0.0223 0.0621
Mycobacterium tuberculosis Carboxylesterase LipT 0.003 0.0223 0.1451
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0036 0.0784
Schistosoma mansoni gliotactin 0.003 0.0223 0.0223
Mycobacterium tuberculosis Probable oxidoreductase 0.0116 0.1536 1
Echinococcus multilocularis para nitrobenzyl esterase 0.003 0.0223 0.0223
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.018 0.2516 0.2516
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0 0.5
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.003 0.0223 0.0621
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0697 0.0697
Brugia malayi RNA binding protein 0.0061 0.0697 0.1942
Echinococcus granulosus para nitrobenzyl esterase 0.003 0.0223 0.0223
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0497 0.1384
Brugia malayi Carboxylesterase family protein 0.003 0.0223 0.0621
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.2407 0.6706
Loa Loa (eye worm) hypothetical protein 0.003 0.0223 0.0526
Echinococcus granulosus family S9 non peptidase ue S09 family 0.003 0.0223 0.0223
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0036 1
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Trypanosoma brucei trypanothione reductase 0.0046 0.0459 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0497 0.1297
Mycobacterium tuberculosis Probable reductase 0.0105 0.1358 0.8837
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0263 0.0731
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0116 0.1536 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0036 0.0036
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0036 0.0036
Loa Loa (eye worm) glutathione reductase 0.0046 0.0459 0.1189
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0105 0.1358 0.8837
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0105 0.1358 0.8837
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.0697 0.1942
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0497 0.1297
Echinococcus granulosus BC026374 protein S09 family 0.003 0.0223 0.0223
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0036 0.0784
Echinococcus granulosus muscleblind protein 0.0145 0.1974 0.1974
Echinococcus granulosus carboxylesterase 5A 0.018 0.2516 0.2516
Plasmodium falciparum thioredoxin reductase 0.0046 0.0459 1
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.2272 0.6328
Echinococcus multilocularis acetylcholinesterase 0.018 0.2516 0.2516
Schistosoma mansoni ap endonuclease 0.0018 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0145 0.1974 0.5453
Brugia malayi Thioredoxin reductase 0.0046 0.0459 0.1278
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0251 0.359 1
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.359 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0046 0.0459 0.0459
Trypanosoma cruzi trypanothione reductase, putative 0.0046 0.0459 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

Bibliographic References

No literature references available for this target.

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