Detailed information for compound 674899

Basic information

Technical information
  • TDR Targets ID: 674899
  • Name: 3-(3-methoxyphenyl)-1-(oxolan-2-ylmethyl)thio urea
  • MW: 266.359 | Formula: C13H18N2O2S
  • H donors: 2 H acceptors: 0 LogP: 1.9 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1)NC(=S)NCC1CCCO1
  • InChi: 1S/C13H18N2O2S/c1-16-11-5-2-4-10(8-11)15-13(18)14-9-12-6-3-7-17-12/h2,4-5,8,12H,3,6-7,9H2,1H3,(H2,14,15,18)
  • InChiKey: HIJJNAXMAPTPRE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(3-methoxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea
  • 3-(3-methoxyphenyl)-1-(2-tetrahydrofuranylmethyl)thiourea
  • 3-(3-methoxyphenyl)-1-(tetrahydrofurfuryl)thiourea
  • STK144373

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
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0129 0.4532 0.4532
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0047 0.0584 1
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.0066 0.5
Schistosoma mansoni tar DNA-binding protein 0.0129 0.4532 0.707
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0584 0.5
Brugia malayi RNA binding protein 0.0129 0.4532 0.4496
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.2714 0.2714
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0066 0.5
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0166 0.6353 0.6353
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0584 0.3021
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0072 0.178 0.1725
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0584 0.0521
Schistosoma mansoni tar DNA-binding protein 0.0129 0.4532 0.707
Loa Loa (eye worm) hypothetical protein 0.0047 0.0584 0.0584
Echinococcus multilocularis tar DNA binding protein 0.0129 0.4532 0.4496
Loa Loa (eye worm) hypothetical protein 0.0241 1 1
Loa Loa (eye worm) RNA binding protein 0.0129 0.4532 0.4532
Echinococcus multilocularis lysosomal alpha glucosidase 0.0166 0.6353 0.6329
Echinococcus granulosus tar DNA binding protein 0.0129 0.4532 0.4496
Schistosoma mansoni hypothetical protein 0.0049 0.0666 0.0948
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0584 1
Onchocerca volvulus 0.0049 0.0666 0.0345
Schistosoma mansoni tar DNA-binding protein 0.0129 0.4532 0.707
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.0666 0.0603
Echinococcus granulosus lysosomal alpha glucosidase 0.0166 0.6353 0.6329
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0035 0 0.5
Brugia malayi hypothetical protein 0.0072 0.178 0.1725
Schistosoma mansoni transcription factor LCR-F1 0.0072 0.178 0.2712
Loa Loa (eye worm) hypothetical protein 0.0047 0.0584 0.0584
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.2714 0.2665
Schistosoma mansoni alpha-glucosidase 0.0143 0.5228 0.8171
Entamoeba histolytica acyl-coA synthetase, putative 0.0047 0.0584 0.3021
Entamoeba histolytica hypothetical protein 0.0072 0.178 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0584 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0584 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.2714 0.2665
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.2714 0.4191
Echinococcus granulosus survival motor neuron protein 1 0.0241 1 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0047 0.0584 1
Echinococcus multilocularis geminin 0.0167 0.6383 0.6359
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0047 0.0584 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0584 0.0584
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0066 0.5
Trypanosoma brucei glucosidase, putative 0.0037 0.0066 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0072 0.178 0.1725
Loa Loa (eye worm) TAR-binding protein 0.0129 0.4532 0.4532
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0584 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0066 0.5
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0584 0.3021
Schistosoma mansoni alpha-glucosidase 0.0143 0.5228 0.8171
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0047 0.0584 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0066 0.5
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.0066 0.5
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0584 0.0521
Entamoeba histolytica hypothetical protein 0.0072 0.178 1
Schistosoma mansoni tar DNA-binding protein 0.0129 0.4532 0.707
Schistosoma mansoni survival motor neuron protein 0.0049 0.0666 0.0948
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0047 0.0584 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0584 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0129 0.4532 0.4496
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.2714 0.4191
Schistosoma mansoni hypothetical protein 0.0167 0.6383 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.0066 0.5
Onchocerca volvulus 0.0096 0.2947 1
Echinococcus multilocularis survival motor neuron protein 1 0.0241 1 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0166 0.6353 0.6329
Schistosoma mansoni hypothetical protein 0.0167 0.6383 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0584 1
Entamoeba histolytica hypothetical protein 0.0072 0.178 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.2714 0.2665
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0066 0.5
Plasmodium vivax acyl-CoA synthetase, putative 0.0035 0 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0066 0.5
Entamoeba histolytica hypothetical protein 0.0072 0.178 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.2714 0.2665
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.0066 0.0066
Schistosoma mansoni hypothetical protein 0.0072 0.178 0.2712
Mycobacterium ulcerans hypothetical protein 0.0047 0.0584 1
Brugia malayi TAR-binding protein 0.0129 0.4532 0.4496
Echinococcus granulosus geminin 0.0167 0.6383 0.6359
Plasmodium falciparum acyl-CoA synthetase 0.0035 0 0.5
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0047 0.0584 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0584 1
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0066 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.2714 0.4191
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0066 0.5
Schistosoma mansoni tar DNA-binding protein 0.0129 0.4532 0.707
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0066 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.2714 0.2665
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0584 0.0521
Echinococcus multilocularis lysosomal alpha glucosidase 0.0166 0.6353 0.6329

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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