Detailed information for compound 170253

Basic information

Technical information
  • TDR Targets ID: 170253
  • Name: 5-[[4-[(3-methyl-5-propan-2-yloxyimidazo[4,5- b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thi azolidine-2,4-dione
  • MW: 426.489 | Formula: C21H22N4O4S
  • H donors: 1 H acceptors: 4 LogP: 3.45 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Oc1ccc2c(n1)n(C)c(n2)COc1ccc(cc1)CC1SC(=O)NC1=O)C
  • InChi: 1S/C21H22N4O4S/c1-12(2)29-18-9-8-15-19(23-18)25(3)17(22-15)11-28-14-6-4-13(5-7-14)10-16-20(26)24-21(27)30-16/h4-9,12,16H,10-11H2,1-3H3,(H,24,26,27)
  • InChiKey: NYZCYOCLLSTCPQ-UHFFFAOYSA-N  

Network

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Synonyms

  • 5-[[4-[(5-isopropoxy-3-methyl-imidazo[4,5-b]pyridin-2-yl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
  • 5-[[4-[(5-isopropoxy-3-methyl-2-imidazo[4,5-b]pyridinyl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
  • 5-[[4-[(3-methyl-5-propan-2-yloxy-imidazo[4,5-b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
  • 5-[4-[(5-isopropoxy-3-methyl-imidazo[4,5-b]pyridin-2-yl)methoxy]benzyl]thiazolidine-2,4-quinone
  • 5-[[4-[(3-methyl-5-propan-2-yloxyimidazo[5,4-b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
  • 5-[[4-[(5-isopropoxy-3-methyl-imidazo[5,4-b]pyridin-2-yl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
  • 5-[[4-[(5-isopropoxy-3-methyl-2-imidazo[5,4-b]pyridinyl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
  • 5-[4-[(5-isopropoxy-3-methyl-imidazo[5,4-b]pyridin-2-yl)methoxy]benzyl]thiazolidine-2,4-quinone
  • 5-[[4-[(3-methyl-5-propan-2-yloxy-imidazo[5,4-b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

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 L-lactate dehydrogenase 0.0592 0.5723 0.5723
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0764 0.7621 0.7271
Echinococcus granulosus malate dehydrogenase 0.0764 0.7621 0.7621
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Plasmodium vivax malate dehydrogenase, putative 0.098 1 1
Echinococcus granulosus cytosolic malate dehydrogenase 0.0829 0.8334 0.8334
Loa Loa (eye worm) malate dehydrogenase 0.0829 0.8334 0.8334
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0829 0.8334 1
Wolbachia endosymbiont of Brugia malayi malate dehydrogenase 0.098 1 0.5
Schistosoma mansoni malate dehydrogenase 0.098 1 1
Giardia lamblia Malate dehydrogenase 0.0829 0.8334 0.5
Trypanosoma brucei mitochondrial malate dehydrogenase 0.0764 0.7621 0.7271
Trichomonas vaginalis malate dehydrogenase, putative 0.0592 0.5723 0.5611
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0829 0.8334 1
Echinococcus granulosus malate dehydrogenase 0.0764 0.7621 0.7621
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0829 0.8334 1
Plasmodium falciparum L-lactate dehydrogenase 0.098 1 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Trypanosoma brucei glycosomal malate dehydrogenase 0.0764 0.7621 0.7271
Echinococcus multilocularis lactate dehydrogenase a 0.098 1 1
Trypanosoma brucei cytosolic malate dehydrogenase 0.0829 0.8334 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0829 0.8334 0.8334
Chlamydia trachomatis malate dehydrogenase 0.0829 0.8334 0.5
Trypanosoma cruzi malate dehydrogenase, putative 0.0764 0.7621 0.7271
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0829 0.8334 0.8334
Mycobacterium leprae PROBABLE MALATE DEHYDROGENASE MDH 0.0829 0.8334 0.5
Echinococcus granulosus L lactate dehydrogenase B chain 0.098 1 1
Toxoplasma gondii lactate dehydrogenase LDH2 0.098 1 0.5
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0829 0.8334 0.8334
Schistosoma mansoni malate dehydrogenase 0.0764 0.7621 0.7621
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Entamoeba histolytica malate dehydrogenase, putative 0.098 1 1
Echinococcus granulosus lactate dehydrogenase a 0.098 1 1
Echinococcus multilocularis malate dehydrogenase 0.0764 0.7621 0.7621
Plasmodium falciparum malate dehydrogenase 0.098 1 1
Echinococcus granulosus cytosolic malate dehydrogenase 0.0829 0.8334 0.8334
Schistosoma mansoni malate dehydrogenase 0.0829 0.8334 0.8334
Trichomonas vaginalis malate dehydrogenase, putative 0.0525 0.4996 0.4389
Schistosoma mansoni malate dehydrogenase 0.0829 0.8334 0.8334
Toxoplasma gondii malate dehydrogenase MDH 0.098 1 0.5
Leishmania major glycosomal malate dehydrogenase 0.0764 0.7621 0.4439
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Schistosoma mansoni L-lactate dehydrogenase 0.098 1 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Echinococcus granulosus L lactate dehydrogenase 0.0389 0.3491 0.3491
Plasmodium vivax lactate dehydrogenase 0.098 1 1
Echinococcus multilocularis lactate dehydrogenase a 0.098 1 1
Leishmania major malate dehydrogenase 0.0764 0.7621 0.4439
Trypanosoma cruzi mitochondrial malate dehydrogenase, putative 0.0764 0.7621 0.7271
Echinococcus multilocularis malate dehydrogenase 0.0764 0.7621 0.7621
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Echinococcus multilocularis L lactate dehydrogenase B chain 0.098 1 1
Echinococcus granulosus lactate dehydrogenase protein 0.098 1 1
Echinococcus multilocularis L lactate dehydrogenase 0.0389 0.3491 0.3491
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0764 0.7621 0.7271
Brugia malayi Probable malate dehydrogenase, mitochondrial precursor 0.0764 0.7621 0.7621
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0829 0.8334 1
Echinococcus multilocularis lactate dehydrogenase a 0.098 1 1
Echinococcus multilocularis lactate dehydrogenase protein 0.098 1 1
Echinococcus granulosus lactate dehydrogenase a 0.098 1 1
Loa Loa (eye worm) malate dehydrogenase 0.0764 0.7621 0.7621
Leishmania major mitochondrial malate dehydrogenase 0.0764 0.7621 0.4439
Leishmania major cytosolic malate dehydrogenase 0.0829 0.8334 0.6105
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0829 0.8334 1
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0829 0.8334 1
Mycobacterium tuberculosis Probable malate dehydrogenase Mdh 0.0829 0.8334 0.5
Mycobacterium ulcerans malate dehydrogenase 0.0829 0.8334 0.5
Loa Loa (eye worm) hypothetical protein 0.098 1 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Toxoplasma gondii lactate dehydrogenase LDH1 0.098 1 0.5
Leishmania major malate dehydrogenase, putative 0.098 1 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0829 0.8334 1

Activities

Activity type Activity value Assay description Source Reference
Decrease (functional) = -0.2 % The hypoglycemic activity in diabetic KK mice,activity expressed as % decrease in blood glucose (21h) ChEMBL. 10956213
Decrease (functional) = 14.6 % The hypoglycemic activity in diabetic KK mice,activity expressed as % decrease in blood glucose (18 h) ChEMBL. 10956213
EC (functional) = 0.075 uM Stimulation of adipogenesis in 3T3-L1 cells is expressed as concentration equivalent to the [ 1-14C] uptake counts after treatment with 0.2 ug/mL troglitazone ChEMBL. 10956213
EC (functional) = 0.075 uM Stimulation of adipogenesis in 3T3-L1 cells is expressed as concentration equivalent to the [ 1-14C] uptake counts after treatment with 0.2 ug/mL troglitazone ChEMBL. 10956213

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

1 literature reference was collected for this gene.

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