Detailed information for compound 152850

Basic information

Technical information
  • TDR Targets ID: 152850
  • Name: 7-chloro-6,8-dimethyl-1,4-dihydropyrido[2,3-b ]pyrazine-2,3-dione
  • MW: 225.632 | Formula: C9H8ClN3O2
  • H donors: 2 H acceptors: 5 LogP: 1.82 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1nc2c(nc1O)nc(c(c2C)Cl)C
  • InChi: 1S/C9H8ClN3O2/c1-3-5(10)4(2)11-7-6(3)12-8(14)9(15)13-7/h1-2H3,(H,12,14)(H,11,13,15)
  • InChiKey: CRQJSZDHUTZIPP-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 7-chloro-6,8-dimethyl-1,4-dihydropyrido[2,3-b]pyrazine-2,3-quinone
  • 7-chloro-6,8-dimethyl-1,4-dihydropyrido[3,2-e]pyrazine-2,3-dione
  • 7-chloro-6,8-dimethyl-1,4-dihydropyrido[3,2-e]pyrazine-2,3-quinone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Glutamate (NMDA) receptor subunit zeta 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni glutamate receptor NMDA Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus multilocularis nmda type glutamate receptor Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus granulosus glutamate receptor NMDA Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus multilocularis glutamate receptor NMDA Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus multilocularis nmda type glutamate receptor Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus granulosus nmda type glutamate receptor Get druggable targets OG5_133478 All targets in OG5_133478
Schistosoma japonicum Glutamate [NMDA] receptor subunit zeta-1 precursor, putative Get druggable targets OG5_133478 All targets in OG5_133478
Echinococcus granulosus nmda type glutamate receptor Get druggable targets OG5_133478 All targets in OG5_133478
Schistosoma japonicum expressed protein Get druggable targets OG5_133478 All targets in OG5_133478
Schistosoma japonicum Glutamate [NMDA] receptor subunit zeta-1 precursor, putative Get druggable targets OG5_133478 All targets in OG5_133478
Schistosoma japonicum Glutamate [NMDA] receptor subunit zeta-1 precursor, putative Get druggable targets OG5_133478 All targets in OG5_133478

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Drosophila melanogaster Glutamate receptor IA Glutamate (NMDA) receptor subunit zeta 1   938 aa 979 aa 23.7 %
Drosophila melanogaster NMDA receptor 2 Glutamate (NMDA) receptor subunit zeta 1   938 aa 878 aa 27.4 %
Echinococcus multilocularis glutamate (NMDA) receptor subunit Glutamate (NMDA) receptor subunit zeta 1   938 aa 822 aa 23.2 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0996 0.3359 1
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0996 0.3359 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0142 0.0385 0.0168
Echinococcus multilocularis receptor type tyrosine protein phosphatase H 0.0142 0.0385 0.0385
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0151 0.0415 0.0415
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Schistosoma mansoni protein tyrosine phosphatase 0.0151 0.0415 0.0342
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0168
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0168
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0385
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0134 0.0355 0.0282
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0307 0.0958 0.1928
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0142 0.0385 0.0385
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0151 0.0415 0.0415
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 0.0142 0.0385 0.0944
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0168
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0996 0.3359 0.3309
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0168
Loa Loa (eye worm) hypothetical protein 0.0276 0.0851 0.0782
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 0.0142 0.0385 0.0944
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0151 0.0415 0.0199
Onchocerca volvulus 0.0142 0.0385 0.0944
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0151 0.0415 0.0415
Leishmania major hypothetical protein, conserved 0.0307 0.0958 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Schistosoma mansoni rgs-gaip interacting protein gipc 0.0142 0.0385 0.0312
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0168
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0134 0.0355 0.0282
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0142 0.0385 0.0385
Loa Loa (eye worm) protein-tyrosine-phosphatase 0.0142 0.0385 0.0312
Trypanosoma cruzi hypothetical protein, conserved 0.0307 0.0958 1
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0385
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Echinococcus granulosus Receptor type tyrosine protein phosphatase O 0.0142 0.0385 0.0168
Echinococcus granulosus nmda type glutamate receptor 0.01 0.0237 0.0016
Brugia malayi Protein-tyrosine phosphatase 0.0285 0.0881 0.0812
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0142 0.0385 0.0385
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Echinococcus multilocularis protein tyrosine phosphatase n9 0.0142 0.0385 0.0385
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus multilocularis glutamate receptor NMDA 0.0095 0.0221 0.0221
Trypanosoma cruzi hypothetical protein, conserved 0.0307 0.0958 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0996 0.3359 1
Loa Loa (eye worm) fibronectin type III domain-containing protein 0.0151 0.0415 0.0342
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0168
Onchocerca volvulus 0.0142 0.0385 0.0944
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0151 0.0415 0.0342
Brugia malayi Protein-tyrosine phosphatase 1 0.0142 0.0385 0.0312
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0151 0.0415 0.0342
Onchocerca volvulus 0.0142 0.0385 0.0944
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.0142 0.0385 0.0312
Schistosoma mansoni protein-tyrosine phosphatase non-receptor type nt5 0.0142 0.0385 0.0312
Echinococcus granulosus protein tyrosine phosphatase n9 0.0142 0.0385 0.0168
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0996 0.3359 0.5
Schistosoma mansoni glutamate receptor NMDA 0.0109 0.0268 0.0194
Brugia malayi hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.2901 1 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.2901 1 1
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0996 0.3359 1
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0385
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0307 0.0958 1
Brugia malayi hypothetical protein 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0151 0.0415 0.0199
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Brugia malayi hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0142 0.0385 0.0385
Loa Loa (eye worm) protein-tyrosine phosphatase 1 0.0142 0.0385 0.0312
Schistosoma mansoni pcd6 interacting protein-related 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0385
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0151 0.0415 0.0199
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0996 0.3359 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Schistosoma mansoni protein tyrosine phosphatase 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0142 0.0385 0.0385
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0385
Schistosoma mansoni receptor protein tyrosine phosphatase 0.0151 0.0415 0.0342
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0385
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0168
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0151 0.0415 0.0415
Onchocerca volvulus 0.0142 0.0385 0.0944
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0996 0.3359 1
Brugia malayi protein-tyrosine phosphatase Lar-like precursor, putative 0.0142 0.0385 0.0312
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0168
Echinococcus multilocularis nmda type glutamate receptor 0.01 0.0237 0.0237
Onchocerca volvulus 0.0142 0.0385 0.0944
Loa Loa (eye worm) dual specificity protein phosphatase CDC14B 0.0142 0.0385 0.0312
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0151 0.0415 0.0342
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0151 0.0415 0.0415
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.2901 1 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0996 0.3359 1
Schistosoma mansoni receptor protein tyrosine phosphatase r (pcptp1) 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus multilocularis hypothetical protein 0.0142 0.0385 0.0385
Echinococcus granulosus Receptor type tyrosine protein phosphatase O 0.0142 0.0385 0.0168
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0689 0.2289 0.5
Echinococcus granulosus nmda type glutamate receptor 0.0127 0.0332 0.0114
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0996 0.3359 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Schistosoma mansoni protein-tyrosine phosphatase n9 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0142 0.0385 0.0312
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0142 0.0385 0.0385
Loa Loa (eye worm) protein tyrosine phosphatase 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Echinococcus multilocularis 0.0142 0.0385 0.0385
Brugia malayi Dual specificity protein phosphatase CDC14B 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0134 0.0355 0.0282
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0996 0.3359 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0151 0.0415 0.0199
Schistosoma mansoni non-receptor protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 0.0142 0.0385 0.0944
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0151 0.0415 0.0415
Onchocerca volvulus 0.0142 0.0385 0.0944
Onchocerca volvulus 4.1 G protein, putative homolog 0.0142 0.0385 0.0944
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Echinococcus multilocularis nmda type glutamate receptor 0.0127 0.0332 0.0332
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0142 0.0385 0.0312
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.2901 1 1
Onchocerca volvulus 0.0142 0.0385 0.0944
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0142 0.0385 0.0312
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0307 0.0958 0.1928
Onchocerca volvulus 0.0142 0.0385 0.0944
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0996 0.3359 1
Onchocerca volvulus 0.0142 0.0385 0.0944
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0151 0.0415 0.0342
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0385
Brugia malayi hypothetical protein 0.0142 0.0385 0.0312
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0142 0.0385 0.0312
Loa Loa (eye worm) hypothetical protein 0.0142 0.0385 0.0312
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0168
Schistosoma mansoni protein tyrosine phosphatase 0.0142 0.0385 0.0312
Brugia malayi hypothetical protein 0.0142 0.0385 0.0312
Onchocerca volvulus 0.0142 0.0385 0.0944
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.0996 0.3359 0.3309
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0142 0.0385 0.0168

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = -6.09 In vitro binding affinity for glycine site on the NMDA receptor. ChEMBL. No reference
Log Ki (binding) = 6.09 In vitro binding affinity for glycine site on the NMDA receptor. ChEMBL. No reference

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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