Detailed information for compound 901979

Basic information

Technical information
  • TDR Targets ID: 901979
  • Name: N-[4-[(4-diethylamino-6-methylpyrimidin-2-yl) amino]phenyl]-3-methoxybenzamide
  • MW: 405.493 | Formula: C23H27N5O2
  • H donors: 2 H acceptors: 3 LogP: 4.47 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1)C(=O)Nc1ccc(cc1)Nc1nc(C)cc(n1)N(CC)CC
  • InChi: 1S/C23H27N5O2/c1-5-28(6-2)21-14-16(3)24-23(27-21)26-19-12-10-18(11-13-19)25-22(29)17-8-7-9-20(15-17)30-4/h7-15H,5-6H2,1-4H3,(H,25,29)(H,24,26,27)
  • InChiKey: KUJCDCGPVKDLPK-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-[4-[(4-diethylamino-6-methyl-pyrimidin-2-yl)amino]phenyl]-3-methoxy-benzamide
  • N-[4-[(4-diethylamino-6-methyl-2-pyrimidinyl)amino]phenyl]-3-methoxybenzamide

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
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0009 0.0164 0.0146
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0234 0.0662
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0164 0.0447
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0234 0.0662
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Schistosoma mansoni hypothetical protein 0.0016 0.0559 0.1701
Mycobacterium leprae putative cytochrome p450 0.0007 0.0057 0.5
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0234 0.0662
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0007 0.0057 0.5
Echinococcus granulosus GPCR family 2 0.0016 0.0559 0.1656
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Brugia malayi MH2 domain containing protein 0.0008 0.0121 0.0103
Schistosoma mansoni hypothetical protein 0.0016 0.0559 0.1701
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Schistosoma mansoni dishevelled 0.0009 0.0164 0.0499
Schistosoma mansoni guanine-nucleotide-exchange-factor 0.0006 0.0018 0.0054
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.3285 0.3273
Brugia malayi MH1 domain containing protein 0.0008 0.0121 0.0103
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0234 0.0217
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0234 0.0712
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0559 0.1656
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0234 0.0662
Echinococcus granulosus tar DNA binding protein 0.0063 0.3285 1
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0164 0.0447
Trypanosoma cruzi cytochrome P450, putative 0.0024 0.1054 1
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0164 0.0447
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0234 0.0217
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Echinococcus granulosus Smad4 0.0008 0.0121 0.0316
Brugia malayi Cytochrome P450 family protein 0.0024 0.1054 0.1038
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0234 0.0662
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0234 0.0217
Leishmania major cytochrome p450-like protein 0.0024 0.1054 1
Brugia malayi DIX domain containing protein 0.0009 0.0164 0.0146
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0234 0.0217
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0121 0.0103
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0234 0.0712
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0007 0.0057 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0234 0.0217
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.2512 0.2498
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0234 0.0217
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0234 0.0662
Schistosoma mansoni tar DNA-binding protein 0.0063 0.3285 1
Schistosoma mansoni smad1 5 8 and 0.0008 0.0121 0.0368
Loa Loa (eye worm) cytochrome P450 family protein 0.0024 0.1054 0.1038
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0164 0.0146
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0007 0.0057 0.0382
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0164 0.0499
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0234 0.0662
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0234 0.0662
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0234 0.0662
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0164 0.0447
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0121 0.0368
Loa Loa (eye worm) hypothetical protein 0.0017 0.0651 0.0635
Schistosoma mansoni tar DNA-binding protein 0.0063 0.3285 1
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0164 0.0447
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0007 0.0057 0.5
Echinococcus multilocularis 0.0007 0.0057 0.0121
Loa Loa (eye worm) Smad1 0.0008 0.0121 0.0103
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0559 0.1656
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0559 0.1656
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0007 0.0057 0.5
Schistosoma mansoni tar DNA-binding protein 0.0063 0.3285 1
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0007 0.0057 0.5
Brugia malayi MH2 domain containing protein 0.0008 0.0121 0.0103
Trichomonas vaginalis ras GTP exchange factor, putative 0.0006 0.0018 0.5
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0007 0.0057 0.5
Schistosoma mansoni smad1 5 8 and 0.0008 0.0121 0.0368
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.6496 0.649
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0234 0.0662
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0234 0.0217
Brugia malayi MH1 domain containing protein 0.0008 0.0121 0.0103
Schistosoma mansoni thyroid hormone receptor 0.001 0.0234 0.0712
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0121 0.0316
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0024 0.1054 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.1608 0.1593
Loa Loa (eye worm) DIX domain-containing protein 0.0009 0.0164 0.0146
Loa Loa (eye worm) hypothetical protein 0.0016 0.0559 0.0542
Schistosoma mansoni thyroid hormone receptor 0.001 0.0234 0.0712
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0007 0.0057 0.5
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0007 0.0057 0.5
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0164 0.0447
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0234 0.0712
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0559 0.0542
Schistosoma mansoni dep domain containing protein 0.0009 0.0164 0.0499
Brugia malayi TAR-binding protein 0.0063 0.3285 0.3273
Brugia malayi nuclear receptor NHR-88 0.001 0.0234 0.0217
Onchocerca volvulus 0.0009 0.0164 0.0146
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0234 0.0217
Trypanosoma brucei cytochrome P450, putative 0.0024 0.1054 1
Schistosoma mansoni smad 0.0008 0.0121 0.0368
Echinococcus granulosus FTZ F1 alpha 0.001 0.0234 0.0662
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0234 0.0217
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0559 0.1656
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0018 0.0054
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0559 0.0542
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0234 0.0217
Loa Loa (eye worm) hypothetical protein 0.0009 0.0164 0.0146
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0164 0.0447
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0007 0.0057 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0234 0.0712
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0234 0.0662
Schistosoma mansoni coup transcription factor 0.001 0.0234 0.0712
Brugia malayi ecdysteroid receptor 0.001 0.0234 0.0217
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0007 0.0057 0.5
Schistosoma mansoni hypothetical protein 0.0034 0.1608 0.4894
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0234 0.0217
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0121 0.0316
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0234 0.0217
Brugia malayi Cytochrome P450 family protein 0.0007 0.0057 0.004
Loa Loa (eye worm) hypothetical protein 0.0009 0.0164 0.0146
Trichomonas vaginalis ras GTP exchange factor, putative 0.0006 0.0018 0.5
Schistosoma mansoni tar DNA-binding protein 0.0063 0.3285 1
Brugia malayi RNA binding protein 0.0063 0.3285 0.3273
Brugia malayi nuclear hormone receptor 0.001 0.0234 0.0217
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0559 0.0542
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.2512 0.2498
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0234 0.0217
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0234 0.0712
Brugia malayi hypothetical protein 0.0009 0.0164 0.0146
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0007 0.0057 0.5
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0164 0.0447
Echinococcus granulosus cytochrome P450 2K1 0.0007 0.0057 0.0121
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0121 0.0316
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.018 1 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0234 0.0217
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0234 0.0662
Brugia malayi Cytochrome P450 family protein 0.0007 0.0057 0.004
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0234 0.0217
Brugia malayi MH2 domain containing protein 0.0119 0.6496 0.649
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0234 0.0217
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0234 0.0662
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0164 0.0499
Loa Loa (eye worm) hypothetical protein 0.0009 0.0164 0.0146
Trichomonas vaginalis ras GTP exchange factor, son of sevenless, putative 0.0006 0.0018 0.5
Loa Loa (eye worm) hypothetical protein 0.005 0.2512 0.2498
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0007 0.0057 0.5
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0164 0.0447
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0234 0.0217
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0234 0.0712
Loa Loa (eye worm) hypothetical protein 0.018 1 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0007 0.0057 0.0382
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0234 0.0217
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0234 0.0217
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0121 0.0103
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0234 0.0662
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0007 0.0057 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0234 0.0217
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0018 0.0054
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Toxoplasma gondii hypothetical protein 0.0009 0.0164 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.2512 0.2498
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0164 0.0499
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0007 0.0057 0.5
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0007 0.0057 0.004
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Echinococcus granulosus smad 0.0008 0.0121 0.0316
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0234 0.0712
Trichomonas vaginalis guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0164 0.0146
Loa Loa (eye worm) cytochrome P450 family protein 0.0024 0.1054 0.1038
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.1608 0.1593
Schistosoma mansoni hypothetical protein 0.0007 0.0057 0.0174
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.3285 0.3273
Loa Loa (eye worm) cytochrome P450 0.0007 0.0057 0.004
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0234 0.0217
Schistosoma mansoni hypothetical protein 0.0016 0.0559 0.1701
Brugia malayi hypothetical protein 0.0009 0.0164 0.0146
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0007 0.0057 0.0382
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Echinococcus multilocularis GPCR, family 2 0.0016 0.0559 0.1656
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0009 0.0164 0.0146
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0007 0.0057 0.5
Brugia malayi Smad1 0.0008 0.0121 0.0103
Loa Loa (eye worm) CYP4Cod1 0.0024 0.1054 0.1038
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0234 0.0217
Schistosoma mansoni nuclear hormone receptor 0.001 0.0234 0.0712
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0234 0.0662
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0234 0.0712
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0007 0.0057 0.5
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Loa Loa (eye worm) RNA binding protein 0.0063 0.3285 0.3273
Loa Loa (eye worm) TAR-binding protein 0.0063 0.3285 0.3273
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0018 0.5
Schistosoma mansoni ras GTP exchange factor 0.0006 0.0018 0.0054
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0007 0.0057 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0234 0.0712
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Echinococcus multilocularis tar DNA binding protein 0.0063 0.3285 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0007 0.0057 0.5
Echinococcus multilocularis smad 0.0008 0.0121 0.0316
Brugia malayi regulator of G-protein signaling egl-10 0.0009 0.0164 0.0146
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0164 0.0447
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0234 0.0662
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0234 0.0217
Brugia malayi Cytochrome P450 family protein 0.0024 0.1054 0.1038
Loa Loa (eye worm) hypothetical protein 0.001 0.0234 0.0217
Schistosoma mansoni dishevelled 0.0009 0.0164 0.0499
Schistosoma mansoni Smad4 0.0008 0.0121 0.0368
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0234 0.0217
Schistosoma mansoni smad1 5 8 and 0.0008 0.0121 0.0368
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0007 0.0057 0.5
Schistosoma mansoni cytochrome P450 0.0007 0.0057 0.0174
Echinococcus multilocularis Smad4 0.0008 0.0121 0.0316
Onchocerca volvulus 0.001 0.0234 0.0217
Trypanosoma cruzi cytochrome P450, putative 0.0024 0.1054 1
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0007 0.0057 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0234 0.0217
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0121 0.0316
Mycobacterium leprae Conserved hypothetical protein 0.0007 0.0057 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.6496 0.649
Brugia malayi cytochrome P450 0.0007 0.0057 0.004
Schistosoma mansoni hypothetical protein 0.0016 0.0559 0.1701
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0018 0.0054
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0234 0.0217
Brugia malayi steroid hormone receptor 0.001 0.0234 0.0217
Entamoeba histolytica hypothetical protein 0.0006 0.0018 0.5
Schistosoma mansoni tar DNA-binding protein 0.0063 0.3285 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0234 0.0662
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0234 0.0217

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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