Detailed information for compound 831620

Basic information

Technical information
  • TDR Targets ID: 831620
  • Name: N-(2-diethylaminoethyl)-3-(1,3,5,7-tetramethy l-2,4-dioxopyrido[6,5-d]pyrimidin-6-yl)propan amide
  • MW: 389.492 | Formula: C20H31N5O3
  • H donors: 1 H acceptors: 4 LogP: 1.12 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCNC(=O)CCc1c(C)nc2c(c1C)c(=O)n(c(=O)n2C)C)CC
  • InChi: 1S/C20H31N5O3/c1-7-25(8-2)12-11-21-16(26)10-9-15-13(3)17-18(22-14(15)4)23(5)20(28)24(6)19(17)27/h7-12H2,1-6H3,(H,21,26)
  • InChiKey: RYDSITGQBOBLLI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-diethylaminoethyl)-3-(1,3,5,7-tetramethyl-2,4-dioxo-pyrido[6,5-d]pyrimidin-6-yl)propanamide
  • N-(2-diethylaminoethyl)-3-(1,3,5,7-tetramethyl-2,4-dioxo-6-pyrido[6,5-d]pyrimidinyl)propanamide
  • N-(2-diethylaminoethyl)-3-(2,4-diketo-1,3,5,7-tetramethyl-pyrido[6,5-d]pyrimidin-6-yl)propionamide

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
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0054 0.0368
Echinococcus granulosus cpg binding protein 0.0035 0.0054 0.0333
Toxoplasma gondii GNS1/SUR4 family protein 0.1518 0.2829 1
Brugia malayi MH2 domain containing protein 0.0009 0.0006 0.0005
Brugia malayi Inositol-1 0.0042 0.0067 0.0066
Brugia malayi Pre-SET motif family protein 0.0238 0.0434 0.0432
Trypanosoma cruzi fatty acid elongase, putative 0.1518 0.2829 1
Echinococcus multilocularis mixed lineage leukemia protein mll 0.001 0.0007 0.0003
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0017 0.0055
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.003 0.01
Leishmania major fatty acid elongase, putative 0.1518 0.2829 1
Schistosoma mansoni hypothetical protein 0.0042 0.0067 0.0456
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Plasmodium falciparum long chain polyunsaturated fatty acid elongation enzyme, putative 0.0352 0.0648 0.2286
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Trichomonas vaginalis set domain proteins, putative 0.027 0.0495 0.8521
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.003 0.0164
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.003 0.049
Echinococcus multilocularis microtubule associated protein 2 0.0786 0.1459 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0067 0.1114
Onchocerca volvulus 0.027 0.0495 0.7437
Brugia malayi fatty acid elongation protein 3 0.0352 0.0648 0.0647
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0042 0.0067 1
Brugia malayi hypothetical protein 0.0042 0.0067 0.0065
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.005 0.0302
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0088 0.0562
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.0067 0.0416
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Onchocerca volvulus Elongation of very long chain fatty acids protein 5 homolog 0.0352 0.0648 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.003 0.0468
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.003 0.01
Onchocerca volvulus 0.0352 0.0648 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.003 0.01
Schistosoma mansoni fatty acid acyl transferase-related 0.0352 0.0648 0.444
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Echinococcus granulosus dnaJ subfamily B 0.0473 0.0874 0.5971
Brugia malayi fatty acid elongation protein 3 0.0352 0.0648 0.0647
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.0054 0.0185
Entamoeba histolytica hypothetical protein 0.0042 0.0067 0.985
Schistosoma mansoni elongation of fatty acids protein 1 0.0352 0.0648 0.444
Schistosoma mansoni elongation of fatty acids protein 1 0.0352 0.0648 0.444
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.003 0.01
Brugia malayi Fatty acid elongation protein 3 0.1518 0.2829 0.2828
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0009 0.0006 0.0042
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0017 0.0055
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0038 0.0059 1
Giardia lamblia DINP protein human, muc B family 0.0022 0.003 1
Trypanosoma cruzi fatty acid elongase, putative 0.1518 0.2829 1
Loa Loa (eye worm) GNS1/SUR4 family protein 0.1518 0.2829 0.2828
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0072 0.0123 0.0842
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.0088 0.0086
Leishmania major long chain polyunsaturated fatty acid elongation enzyme-like protein 0.0352 0.0648 0.2286
Echinococcus multilocularis inositol monophosphatase 1 0.0042 0.0067 0.042
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.0067 0.0416
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0088 0.0601
Plasmodium vivax elongation of very long chain fatty acids protein 3, putative 0.0352 0.0648 0.2286
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.003 0.01
Echinococcus granulosus inositol monophosphatase 1 0.0042 0.0067 0.042
Trichomonas vaginalis inositol monophosphatase, putative 0.0042 0.0067 0.1114
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.003 0.0468
Schistosoma mansoni cpg binding protein 0.0033 0.0051 0.0349
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0088 0.0601
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Leishmania major DNA polymerase eta, putative 0.0022 0.003 0.01
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0012 0.001 0.0029
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.0067 0.0456
Schistosoma mansoni microtubule-associated protein tau 0.0786 0.1459 1
Brugia malayi Pre-SET motif family protein 0.0035 0.0054 0.0052
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0067 0.0232
Schistosoma mansoni cpg binding protein 0.0035 0.0054 0.0373
Schistosoma mansoni DNA polymerase IV / kappa 0.0007 0.0002 0.001
Echinococcus granulosus dna polymerase eta 0.0022 0.003 0.0164
Loa Loa (eye worm) glutaminase 0.0316 0.058 0.0579
Entamoeba histolytica hypothetical protein 0.0042 0.0067 0.985
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Trypanosoma brucei Fatty acid elongase 0.0352 0.0648 0.2286
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0054 0.0368
Loa Loa (eye worm) hypothetical protein 0.0035 0.0054 0.0052
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.003 0.0028
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0238 0.0434 0.0432
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.003 0.0028
Loa Loa (eye worm) transcription factor SMAD2 0.0136 0.0243 0.0242
Entamoeba histolytica hypothetical protein 0.0042 0.0067 0.985
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0042 0.0067 0.0232
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.003 0.01
Echinococcus multilocularis elongation of very long chain fatty acids 0.0352 0.0648 0.4416
Loa Loa (eye worm) hypothetical protein 0.0352 0.0648 0.0647
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.0088 0.0086
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0042 0.0067 0.1134
Schistosoma mansoni smad1 5 8 and 0.0009 0.0006 0.0042
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0042 0.0067 0.5
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Toxoplasma gondii integral membrane protein, GNS1/SUR4 family protein, putative 0.1518 0.2829 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Loa Loa (eye worm) fatty acid elongation protein 3 0.0352 0.0648 0.0647
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0088 0.0562
Schistosoma mansoni smad1 5 8 and 0.0009 0.0006 0.0042
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.003 0.049
Echinococcus multilocularis elongation of very long chain fatty acids 0.0352 0.0648 0.4416
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.003 0.0028
Trypanosoma brucei Fatty acid elongase 0.0352 0.0648 0.2286
Entamoeba histolytica hypothetical protein 0.0042 0.0067 0.985
Brugia malayi fatty acid elongation protein 3 0.0352 0.0648 0.0647
Schistosoma mansoni mixed-lineage leukemia protein mll 0.001 0.0007 0.0045
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0054 0.0368
Brugia malayi Hypothetical 34.1 kDa protein C40H1.4 in chromosome III 0.0352 0.0648 0.0647
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0088 0.0562
Leishmania major DNA polymerase kappa, putative 0.0022 0.003 0.01
Plasmodium vivax SET domain protein, putative 0.0035 0.0054 0.0185
Schistosoma mansoni elongation of fatty acids protein 1 0.0352 0.0648 0.444
Loa Loa (eye worm) Smad1 0.0009 0.0006 0.0005
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.003 0.01
Trypanosoma brucei unspecified product 0.0022 0.003 0.01
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Trypanosoma cruzi fatty acid elongase, putative 0.0352 0.0648 0.2286
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0067 0.0232
Brugia malayi MH2 domain containing protein 0.0009 0.0006 0.0005
Loa Loa (eye worm) GNS1/SUR4 family protein 0.5349 1 1
Brugia malayi glutaminase DH11.1 0.0316 0.058 0.0579
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0067 0.0232
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.003 0.0205
Loa Loa (eye worm) MH2 domain-containing protein 0.0136 0.0243 0.0242
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.003 0.01
Trypanosoma cruzi fatty acid elongase, putative 0.1518 0.2829 1
Brugia malayi fatty acid elongation protein 3 0.0352 0.0648 0.0647
Loa Loa (eye worm) histone methyltransferase 0.0012 0.001 0.0009
Schistosoma mansoni glutaminase 0.0316 0.058 0.3976
Toxoplasma gondii histone lysine methyltransferase SET1 0.0064 0.0109 0.038
Loa Loa (eye worm) MH2 domain-containing protein 0.0009 0.0006 0.0005
Loa Loa (eye worm) glutaminase 2 0.0316 0.058 0.0579
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0017 0.0055
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.003 0.01
Loa Loa (eye worm) MH1 domain-containing protein 0.0009 0.0006 0.0005
Trypanosoma cruzi fatty acid elongase, putative 0.1518 0.2829 1
Loa Loa (eye worm) fatty acid elongation protein 3 0.1518 0.2829 0.2828
Schistosoma mansoni inositol monophosphatase 0.0042 0.0067 0.046
Loa Loa (eye worm) ELO-9 protein 0.0352 0.0648 0.0647
Echinococcus multilocularis cpg binding protein 0.0035 0.0054 0.0333
Echinococcus granulosus dna polymerase kappa 0.0022 0.003 0.0164
Brugia malayi MH1 domain containing protein 0.0009 0.0006 0.0005
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0067 0.0232
Schistosoma mansoni cpg binding protein 0.0035 0.0054 0.0373
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Echinococcus multilocularis dnaJ subfamily B 0.0473 0.0874 0.5971
Plasmodium falciparum fatty acid elongation protein, GNS1/SUR4 family, putative 0.1518 0.2829 1
Brugia malayi MH1 domain containing protein 0.0009 0.0006 0.0005
Schistosoma mansoni smad1 5 8 and 0.0009 0.0006 0.0042
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0054 0.0368
Brugia malayi Smad1 0.0009 0.0006 0.0005
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0007 0.0003
Loa Loa (eye worm) fatty acid elongation protein 3 0.0352 0.0648 0.0647
Trypanosoma brucei unspecified product 0.0015 0.0017 0.0055
Mycobacterium ulcerans glutaminase 0.0316 0.058 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.003 0.0205
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0007 0.0003
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0088 0.0601
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0012 0.001 0.0029
Loa Loa (eye worm) CXXC zinc finger family protein 0.0033 0.0051 0.0049
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.003 0.0164
Plasmodium falciparum long chain fatty acid elongation enzyme, putative 0.1518 0.2829 1
Trypanosoma brucei Fatty acid elongase 0.1518 0.2829 1
Onchocerca volvulus Elongation of very long chain fatty acids protein homolog 0.0352 0.0648 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.0054 0.0328
Schistosoma mansoni hypothetical protein 0.0473 0.0874 0.5988
Trypanosoma brucei elongation of very long chain fatty acids protein, putative 0.0352 0.0648 0.2286
Schistosoma mansoni DNA polymerase eta 0.0022 0.003 0.0205
Echinococcus granulosus elongation of very long chain fatty acids 0.0352 0.0648 0.4416
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.0054 0.0328
Echinococcus granulosus microtubule associated protein 2 0.0786 0.1459 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0088 0.0562
Toxoplasma gondii fatty acid elongase 0.0352 0.0648 0.2286
Brugia malayi CXXC zinc finger family protein 0.0033 0.0051 0.0049
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0067 0.1114
Plasmodium vivax GNS1/SUR4 domain containing protein 0.1518 0.2829 1
Schistosoma mansoni inositol monophosphatase 0.0042 0.0067 0.046
Schistosoma mansoni elongation of fatty acids protein 1 0.0352 0.0648 0.444
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.003 0.01
Echinococcus granulosus elongation of very long chain fatty acids 0.0352 0.0648 0.4416
Trypanosoma brucei Long chain fatty acyl elongase 0.0352 0.0648 0.2286
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0038 0.0059 0.5
Schistosoma mansoni smad 0.0009 0.0006 0.0042
Brugia malayi MH2 domain containing protein 0.0136 0.0243 0.0242
Brugia malayi GNS1/SUR4 family protein 0.1518 0.2829 0.2828
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Loa Loa (eye worm) fatty acid elongation protein 3 0.0352 0.0648 0.0647
Onchocerca volvulus 0.0352 0.0648 1
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Trypanosoma brucei unspecified product 0.0015 0.0017 0.0055
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.003 0.01
Onchocerca volvulus 0.0035 0.0054 0.0047
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0054 0.0328
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.001 0.0009
Loa Loa (eye worm) hypothetical protein 0.0022 0.003 0.0028
Echinococcus multilocularis dna polymerase eta 0.0022 0.003 0.0164
Leishmania major fatty acid elongase, putative 0.0352 0.0648 0.2286
Leishmania major fatty acid elongase, putative 0.1518 0.2829 1
Schistosoma mansoni Smad4 0.0009 0.0006 0.0042
Echinococcus multilocularis dna polymerase kappa 0.0022 0.003 0.0164
Trichomonas vaginalis glutaminase, putative 0.0316 0.058 1
Onchocerca volvulus Elongation of very long chain fatty acids protein homolog 0.0352 0.0648 1
Echinococcus granulosus mixed lineage leukemia protein mll 0.001 0.0007 0.0003
Leishmania major fatty acid elongase, putative 0.1518 0.2829 1
Loa Loa (eye worm) inositol-1 0.0042 0.0067 0.0066
Plasmodium vivax long chain polyunsaturated fatty acid elongation enzyme, putative 0.0352 0.0648 0.2286

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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