Detailed information for compound 620121

Basic information

Technical information
  • TDR Targets ID: 620121
  • Name: 2-[1-(4-ethoxyphenyl)imidazol-2-yl]sulfanyl-N -[(4-fluorophenyl)methyl]acetamide
  • MW: 385.455 | Formula: C20H20FN3O2S
  • H donors: 1 H acceptors: 2 LogP: 3.79 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1)n1ccnc1SCC(=O)NCc1ccc(cc1)F
  • InChi: 1S/C20H20FN3O2S/c1-2-26-18-9-7-17(8-10-18)24-12-11-22-20(24)27-14-19(25)23-13-15-3-5-16(21)6-4-15/h3-12H,2,13-14H2,1H3,(H,23,25)
  • InChiKey: DRCBVBYVEBHZAR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[[1-(4-ethoxyphenyl)-2-imidazolyl]thio]-N-[(4-fluorophenyl)methyl]acetamide
  • 2-[[1-(4-ethoxyphenyl)imidazol-2-yl]thio]-N-(4-fluorobenzyl)acetamide
  • 2-[1-(4-ethoxyphenyl)imidazol-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide
  • ZINC02723231

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
Echinococcus multilocularis netrin receptor unc 5 0.0063 0.164 0.2555
Brugia malayi mbt repeat family protein 0.0047 0.1005 0.455
Onchocerca volvulus Netrin receptor homolog 0.0063 0.164 1
Echinococcus granulosus TNFR CD27 30 40 95 cysteine rich region 0.0097 0.2906 0.4616
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.1005 0.1521
Echinococcus multilocularis histone acetyltransferase MYST2 0.0053 0.125 0.192
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.1005 0.1005
Loa Loa (eye worm) hypothetical protein 0.0047 0.1005 0.5404
Schistosoma mansoni hypothetical protein 0.0063 0.164 0.164
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1085 0.4979
Brugia malayi mbt repeat family protein 0.0047 0.1005 0.455
Echinococcus granulosus Ankyrin 0.0063 0.164 0.2555
Echinococcus multilocularis Ankyrin 0.0063 0.164 0.2555
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0063 0.164 0.8819
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.1005 0.5404
Echinococcus granulosus histone acetyltransferase MYST2 0.0053 0.125 0.192
Schistosoma mansoni tumor necrosis factor receptor related 0.0097 0.2906 0.2906
Loa Loa (eye worm) hypothetical protein 0.0033 0.0499 0.2684
Schistosoma mansoni myelin transcription factor 1 myt1 0.0053 0.125 0.125
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0568 0.0809
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.145 0.2246
Echinococcus granulosus tumor necrosis factor receptor superfamily 0.0097 0.2906 0.4616
Brugia malayi Uncoordinated protein 44 0.0063 0.164 0.7965
Loa Loa (eye worm) MBCTL1 0.0053 0.125 0.6722
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.1005 0.1521
Loa Loa (eye worm) hypothetical protein 0.0042 0.0817 0.4395
Brugia malayi Bromodomain containing protein 0.0073 0.2019 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0183 0.6213 1
Schistosoma mansoni hypothetical protein 0.0033 0.0499 0.0499
Echinococcus multilocularis tumor necrosis factor receptor superfamily 0.0097 0.2906 0.4616
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.1005 0.1005
Loa Loa (eye worm) hypothetical protein 0.0069 0.186 1
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0063 0.164 0.2555
Echinococcus granulosus death domain containing protein 0.0063 0.164 0.2555
Schistosoma mansoni bromodomain containing protein 0.0062 0.1583 0.1583
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0053 0.125 0.192
Echinococcus granulosus netrin receptor unc 5 0.0063 0.164 0.2555
Brugia malayi Protein kinase domain containing protein 0.0063 0.164 0.7965
Schistosoma mansoni netrin receptor unc5 0.0063 0.164 0.164
Loa Loa (eye worm) hypothetical protein 0.0053 0.125 0.6722
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0568 0.0809
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.145 0.2246
Loa Loa (eye worm) hypothetical protein 0.0049 0.1085 0.5833
Loa Loa (eye worm) hypothetical protein 0.004 0.0746 0.4014
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0063 0.164 0.2555
Loa Loa (eye worm) hypothetical protein 0.0063 0.164 0.8819
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.1005 0.1521
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.1005 0.1005
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0063 0.164 0.164
Loa Loa (eye worm) hypothetical protein 0.0037 0.0659 0.3541
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0053 0.125 0.5868
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0183 0.6213 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0053 0.125 0.192
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.1005 0.1521
Brugia malayi Death domain containing protein 0.0063 0.164 0.7965
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1085 0.4979
Schistosoma mansoni ankyrin 23/unc44 0.0063 0.164 0.164
Brugia malayi Immunoglobulin I-set domain containing protein 0.0063 0.164 0.7965
Echinococcus multilocularis TNFR CD27 30 40 95 cysteine rich region 0.0097 0.2906 0.4616
Loa Loa (eye worm) hypothetical protein 0.0063 0.164 0.8819
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0499 0.183
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0071 0.0071
Brugia malayi Bromodomain containing protein 0.0037 0.0656 0.2673
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1085 0.5833

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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