Detailed information for compound 1700758

Basic information

Technical information
  • TDR Targets ID: 1700758
  • Name: STOCK2S-13011
  • MW: 289.328 | Formula: C19H15NO2
  • H donors: 0 H acceptors: 2 LogP: 2.19 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1C(=O)C2[C@@H](C1=O)C1c3c(C2c2c1cccc2)cccc3
  • InChi: 1S/C19H15NO2/c1-20-18(21)16-14-10-6-2-3-7-11(10)15(17(16)19(20)22)13-9-5-4-8-12(13)14/h2-9,14-17H,1H3/t14?,15?,16-,17?/m0/s1
  • InChiKey: UNVNRAVERNELKZ-PYCMUAIMSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

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
Plasmodium falciparum phosphoglycerate kinase 0.0169 0.5794 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0692 0.1195
Echinococcus granulosus lysine specific histone demethylase 1A 0.0137 0.4491 0.7752
Brugia malayi MH2 domain containing protein 0.0117 0.365 0.365
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0692 0.0692
Brugia malayi Phosphoglycerate kinase 0.0169 0.5794 0.5794
Brugia malayi Phosphoglycerate kinase 0.0062 0.1402 0.1402
Trypanosoma brucei phosphoglycerate kinase 0.0169 0.5794 1
Loa Loa (eye worm) hypothetical protein 0.0137 0.4491 0.4491
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0062 0.1402 0.242
Schistosoma mansoni phosphoglycerate kinase 0.0169 0.5794 0.5794
Loa Loa (eye worm) hypothetical protein 0.0039 0.0477 0.0477
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0062 0.1402 0.242
Schistosoma mansoni glutaminase 0.0271 1 1
Treponema pallidum phosphoglycerate kinase 0.0169 0.5794 0.5
Entamoeba histolytica phosphoglycerate kinase, putative 0.0169 0.5794 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0692 0.0692
Toxoplasma gondii phosphoglycerate kinase PGKI 0.0169 0.5794 1
Brugia malayi amine oxidase, flavin-containing family protein 0.0039 0.0477 0.0477
Echinococcus multilocularis phosphoglycerate kinase 1 0.0169 0.5794 1
Schistosoma mansoni phosphoglycerate kinase 0.0169 0.5794 0.5794
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0169 0.5794 1
Loa Loa (eye worm) hypothetical protein 0.0169 0.5794 0.5794
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0169 0.5794 1
Chlamydia trachomatis phosphoglycerate kinase 0.0169 0.5794 1
Trypanosoma cruzi 3-phosphoglycerate kinase, glycosomal 0.0062 0.1402 0.242
Mycobacterium ulcerans phosphoglycerate kinase 0.0169 0.5794 0.5794
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0692 0.1195
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0692 0.0692
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0062 0.1402 0.242
Echinococcus granulosus geminin 0.0166 0.5662 0.9772
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0169 0.5794 1
Echinococcus granulosus phosphoglycerate kinase 1 0.0169 0.5794 1
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0137 0.4491 0.7752
Echinococcus multilocularis geminin 0.0166 0.5662 0.9772
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0692 0.0692
Loa Loa (eye worm) hypothetical protein 0.0137 0.4491 0.4491
Loa Loa (eye worm) transcription factor SMAD2 0.0117 0.365 0.365
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0692 0.1195
Loa Loa (eye worm) glutaminase 2 0.0271 1 1
Toxoplasma gondii phosphoglycerate kinase PGKII 0.0169 0.5794 1
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0062 0.1402 0.242
Mycobacterium ulcerans glutaminase 0.0271 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0692 0.0692
Leishmania major phosphoglycerate kinase B, cytosolic 0.0169 0.5794 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0137 0.4491 0.4491
Trypanosoma brucei phosphoglycerate kinase 0.0169 0.5794 1
Plasmodium vivax phosphoglycerate kinase, putative 0.0169 0.5794 1
Loa Loa (eye worm) hypothetical protein 0.0149 0.4968 0.4968
Leishmania major phosphoglycerate kinase C, glycosomal 0.0169 0.5794 1
Schistosoma mansoni hypothetical protein 0.0166 0.5662 0.5662
Onchocerca volvulus 0.0149 0.4968 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0692 0.1195
Loa Loa (eye worm) MH2 domain-containing protein 0.0117 0.365 0.365
Trichomonas vaginalis glutaminase, putative 0.0271 1 1
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0169 0.5794 1
Schistosoma mansoni hypothetical protein 0.0166 0.5662 0.5662
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0062 0.1402 0.242
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0169 0.5794 0.5
Loa Loa (eye worm) glutaminase 0.0271 1 1
Giardia lamblia Phosphoglycerate kinase 0.0169 0.5794 0.5
Brugia malayi SWIRM domain containing protein 0.0149 0.4968 0.4968

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 56.2341 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) 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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.