Detailed information for compound 266919

Basic information

Technical information
  • TDR Targets ID: 266919
  • Name: 3-methylimidazolidine-2,4-dione
  • MW: 114.103 | Formula: C4H6N2O2
  • H donors: 1 H acceptors: 2 LogP: -0.86 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1C(=O)CNC1=O
  • InChi: 1S/C4H6N2O2/c1-6-3(7)2-5-4(6)8/h2H2,1H3,(H,5,8)
  • InChiKey: MZQQHYDUINOMDG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-methylhydantoin
  • 6843-45-4
  • 2,4-Imidazolidinedione, 3-methyl-
  • Hydantoin, 3-methyl-

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
Entamoeba histolytica hypothetical protein 0.0079 0.0417 1
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0515 0.3448 1
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 1
Entamoeba histolytica hypothetical protein 0.0079 0.0417 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0053 0.0242 0.0585
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 0.1268
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0125 0.0738 0.2142
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0081 0.0437 0.0228
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0028 0.0067 0.0193
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0079 0.0417 0.0208
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0043 0.0126
Echinococcus granulosus thymidylate synthase 0.0515 0.3448 0.3305
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 0.3371
Toxoplasma gondii thioredoxin reductase 0.0049 0.0214 0.0435
Schistosoma mansoni tar DNA-binding protein 0.0141 0.0849 0.0741
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0043 0.0126
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0112 0.0651 0.1889
Loa Loa (eye worm) RNA binding protein 0.0141 0.0849 0.2463
Loa Loa (eye worm) hypothetical protein 0.0081 0.0437 0.1268
Brugia malayi Probable ClpP-like protease 0.0081 0.0437 0.1157
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 0.5
Plasmodium vivax thioredoxin reductase, putative 0.0049 0.0214 0.062
Brugia malayi hypothetical protein 0.0079 0.0417 0.1098
Plasmodium vivax glutathione reductase, putative 0.0049 0.0214 0.062
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0049 0.0214 0.062
Schistosoma mansoni tar DNA-binding protein 0.0141 0.0849 0.0741
Schistosoma mansoni tar DNA-binding protein 0.0141 0.0849 0.0741
Mycobacterium tuberculosis Probable dehydrogenase 0.0112 0.0651 0.1889
Loa Loa (eye worm) TAR-binding protein 0.0141 0.0849 0.2463
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0125 0.0738 0.2142
Trichomonas vaginalis conserved hypothetical protein 0.0245 0.1573 0.5
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0117 0.0338
Brugia malayi RNA binding protein 0.0141 0.0849 0.2367
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.023 0.0548
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 1
Onchocerca volvulus 0.0515 0.3448 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0043 0.0126
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0117 0.0216
Entamoeba histolytica hypothetical protein 0.0079 0.0417 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0043 0.0126
Brugia malayi thymidylate synthase 0.0515 0.3448 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0053 0.0242 0.0703
Leishmania major trypanothione reductase 0.0049 0.0214 0.05
Loa Loa (eye worm) glutathione reductase 0.0049 0.0214 0.062
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0081 0.0437 0.1268
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.0437 0.1096
Echinococcus multilocularis microtubule associated protein 2 0.1459 1 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 0.1268
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0515 0.3448 1
Mycobacterium ulcerans thymidylate synthase 0.0515 0.3448 1
Echinococcus granulosus peptidase Clp S14 family 0.0053 0.0242 0.0029
Mycobacterium tuberculosis Hypothetical protein 0.0245 0.1573 0.4563
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0043 0.0126
Echinococcus multilocularis thymidylate synthase 0.0515 0.3448 0.3305
Echinococcus granulosus tar DNA binding protein 0.0141 0.0849 0.0649
Schistosoma mansoni tar DNA-binding protein 0.0141 0.0849 0.0741
Echinococcus multilocularis tar DNA binding protein 0.0141 0.0849 0.0649
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0081 0.0437 0.0228
Brugia malayi hypothetical protein 0.0245 0.1573 0.4493
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.0437 0.1096
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0125 0.0738 0.2042
Schistosoma mansoni peptidase Clp (S14 family) 0.0081 0.0437 0.0324
Schistosoma mansoni microtubule-associated protein tau 0.1459 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0043 0.0126
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.0214 0.062
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0028 0.0067 0.0193
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0125 0.0738 0.2142
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 1
Mycobacterium ulcerans hypothetical protein 0.0025 0.0043 0.0126
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0112 0.0651 0.1889
Loa Loa (eye worm) hypothetical protein 0.0052 0.023 0.0667
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0079 0.0417 0.0208
Plasmodium falciparum thioredoxin reductase 0.0049 0.0214 0.062
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0245 0.1573 0.4203
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0043 0.0126
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.023 0.0667
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0043 0.0126
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0043 0.0126
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0112 0.0651 0.1889
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0141 0.0849 0.2463
Schistosoma mansoni transcription factor LCR-F1 0.0079 0.0417 0.0304
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0053 0.0242 0.0703
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0081 0.0437 0.1157
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.0437 0.1268
Loa Loa (eye worm) thymidylate synthase 0.0515 0.3448 1
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0028 0.0067 0.0069
Schistosoma mansoni tar DNA-binding protein 0.0141 0.0849 0.0741
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0112 0.0651 0.1889
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0515 0.3448 1
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0515 0.3448 1
Brugia malayi glutathione reductase 0.0049 0.0214 0.05
Brugia malayi RNA recognition motif domain containing protein 0.0141 0.0849 0.2367
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0043 0.0126
Loa Loa (eye worm) hypothetical protein 0.0025 0.0043 0.0126
Brugia malayi TAR-binding protein 0.0141 0.0849 0.2367
Entamoeba histolytica hypothetical protein 0.0079 0.0417 1
Mycobacterium tuberculosis Probable reductase 0.0112 0.0651 0.1889
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.023 0.0548
Brugia malayi Thioredoxin reductase 0.0049 0.0214 0.05
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0043 0.0126
Plasmodium falciparum glutathione reductase 0.0049 0.0214 0.062
Echinococcus multilocularis peptidase Clp (S14 family) 0.0053 0.0242 0.0029
Schistosoma mansoni hypothetical protein 0.0079 0.0417 0.0304
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0112 0.0651 0.1786

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 0 Anticonvulsant activity was evaluated by subcutaneous pentylenetetrazole (Metrazol) (sc Met) seizure test at dose 600 mg/kg; No activity ChEMBL. 3989820
Activity (functional) = 0 Anticonvulsant activity was evaluated by maximal electroshock seizure (MES) test at dose 600 mg/kg; No activity ChEMBL. 3989820
Activity (functional) = 0 Anticonvulsant activity was evaluated by Neurologic toxicity (the rotorod test) at dose 600 mg/kg; No activity ChEMBL. 3989820
Activity (functional) = 0 Anticonvulsant activity was evaluated by maximal electroshock seizure (MES) test at dose 600 mg/kg; No activity ChEMBL. 3989820
Activity (functional) = 0 Anticonvulsant activity was evaluated by subcutaneous pentylenetetrazole (Metrazol) (sc Met) seizure test at dose 600 mg/kg; No activity ChEMBL. 3989820
Activity (functional) = 0 Anticonvulsant activity was evaluated by Neurologic toxicity (the rotorod test) at dose 600 mg/kg; No activity ChEMBL. 3989820

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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