Detailed information for compound 811148

Basic information

Technical information
  • TDR Targets ID: 811148
  • Name: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylp henyl]-5-(4-nitrophenyl)furan-2-carboxamide
  • MW: 473.865 | Formula: C25H16ClN3O5
  • H donors: 1 H acceptors: 4 LogP: 6.14 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc2c(c1)nc(o2)c1ccc(c(c1)NC(=O)c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])C
  • InChi: 1S/C25H16ClN3O5/c1-14-2-3-16(25-28-20-13-17(26)6-9-22(20)34-25)12-19(14)27-24(30)23-11-10-21(33-23)15-4-7-18(8-5-15)29(31)32/h2-13H,1H3,(H,27,30)
  • InChiKey: YIXQDOCSLUHJGY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-(4-nitrophenyl)furan-2-carboxamide
  • N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-(4-nitrophenyl)-2-furancarboxamide
  • N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-(4-nitrophenyl)-2-furamide
  • Oprea1_857692
  • BIM-0009817.P001
  • CBMicro_009665

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 lysosomal alpha glucosidase 0.0163 0.0998 0.2354
Loa Loa (eye worm) nuclear receptor NHR-67 0.0227 0.1563 0.1563
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.029 0.2111 0.2111
Brugia malayi conserved hypotetical protein 0.0227 0.1563 0.1563
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0188 0.122 0.2897
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Brugia malayi Nuclear hormone receptor-like 1 0.029 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.029 0.2111 0.2111
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0227 0.1563 0.374
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0517 0.4114 0.4114
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Loa Loa (eye worm) hypothetical protein 0.1185 1 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0517 0.4114 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0517 0.4114 0.4114
Loa Loa (eye worm) hypothetical protein 0.029 0.2111 0.2111
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0517 0.4114 0.5804
Schistosoma mansoni retinoid-x-receptor (RXR) 0.029 0.2111 0.5084
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0517 0.4114 0.5804
Echinococcus granulosus Nuclear hormone receptor HR96 0.0227 0.1563 0.2171
Brugia malayi nuclear hormone receptor family member odr-7 0.0227 0.1563 0.1563
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0227 0.1563 0.374
Echinococcus granulosus lysosomal alpha glucosidase 0.0163 0.0998 0.1366
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0227 0.1563 0.374
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi nuclear hormone receptor family member nhr-6 0.0227 0.1563 0.1563
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0517 0.4114 0.4114
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0039 0.0039
Schistosoma mansoni nuclear receptor nhr-48 0.0227 0.1563 0.374
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0227 0.1563 0.1563
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0227 0.1563 0.2171
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0517 0.4114 0.4114
Loa Loa (eye worm) hypothetical protein 0.029 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.029 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi nuclear receptor NHR-88 0.0517 0.4114 0.4114
Schistosoma mansoni nuclear hormone receptor 0.0517 0.4114 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0517 0.4114 0.4114
Brugia malayi hypothetical protein 0.029 0.2111 0.2111
Brugia malayi hypothetical protein 0.0227 0.1563 0.1563
Onchocerca volvulus 0.0517 0.4114 0.3874
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0227 0.1563 0.1219
Brugia malayi Nuclear hormone receptor-like 1 0.029 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Echinococcus granulosus Nuclear hormone receptor HR96 0.0227 0.1563 0.2171
Echinococcus granulosus FTZ F1 alpha 0.0517 0.4114 0.5804
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0517 0.4114 0.4114
Schistosoma mansoni nuclear hormone receptor 0.0227 0.1563 0.374
Brugia malayi Glycosyl hydrolases family 31 protein 0.0163 0.0998 0.0998
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Schistosoma mansoni nuclear hormone receptor 0.0227 0.1563 0.374
Schistosoma mansoni thyroid hormone receptor 0.0517 0.4114 1
Schistosoma mansoni alpha-glucosidase 0.0141 0.0798 0.1862
Brugia malayi Nuclear hormone receptor E75 0.0227 0.1563 0.1563
Echinococcus multilocularis geminin 0.017 0.1056 0.2495
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0517 0.4114 0.3874
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0163 0.0998 0.0998
Loa Loa (eye worm) hypothetical protein 0.029 0.2111 0.2111
Onchocerca volvulus Protein ultraspiracle homolog 0.0517 0.4114 0.3874
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0188 0.122 0.1681
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0227 0.1563 0.374
Schistosoma mansoni thyroid hormone receptor 0.0517 0.4114 1
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0227 0.1563 0.374
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Echinococcus granulosus ecdysone induced protein 78C 0.0517 0.4114 0.5804
Brugia malayi Nuclear hormone receptor-like 1 0.0517 0.4114 0.4114
Brugia malayi nuclear receptor NHR-67 0.0227 0.1563 0.1563
Onchocerca volvulus 0.0227 0.1563 0.1219
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi hypothetical protein 0.029 0.2111 0.2111
Brugia malayi ecdysone receptor 0.0227 0.1563 0.1563
Loa Loa (eye worm) MBCTL1 0.0054 0.0039 0.0039
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Echinococcus multilocularis ecdysone induced protein 78C 0.0517 0.4114 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0517 0.4114 1
Loa Loa (eye worm) DR-78 0.0227 0.1563 0.1563
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0517 0.4114 0.4114
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0517 0.4114 0.4114
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0517 0.4114 0.4114
Schistosoma mansoni zinc finger protein 0.0227 0.1563 0.374
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0517 0.4114 0.4114
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0227 0.1563 0.374
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0517 0.4114 0.4114
Echinococcus multilocularis lysosomal alpha glucosidase 0.0163 0.0998 0.2354
Schistosoma mansoni hypothetical protein 0.017 0.1056 0.2495
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0517 0.4114 0.4114
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0517 0.4114 0.4114
Echinococcus granulosus thyroid hormone receptor alpha 0.0851 0.706 1
Schistosoma mansoni nuclear receptor 0.0227 0.1563 0.374
Echinococcus multilocularis nuclear receptor nhr 48 0.0227 0.1563 0.374
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0227 0.1563 0.2171
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0517 0.4114 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0517 0.4114 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0517 0.4114 1
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0227 0.1563 0.1219
Echinococcus multilocularis FTZ F1 alpha 0.0517 0.4114 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0517 0.4114 0.4114
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0517 0.4114 0.4114
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0517 0.4114 0.5804
Brugia malayi steroid hormone receptor 0.1141 0.9611 0.9611
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0517 0.4114 1
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0227 0.1563 0.1563
Schistosoma mansoni retinoic acid receptor RXR 0.0517 0.4114 1
Onchocerca volvulus Bile acid receptor homolog 0.1185 1 1
Echinococcus granulosus geminin 0.017 0.1056 0.1448
Brugia malayi Nuclear hormone receptor E75 0.0227 0.1563 0.1563
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0517 0.4114 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0517 0.4114 0.4114
Loa Loa (eye worm) hypothetical protein 0.0054 0.0039 0.0039
Schistosoma mansoni hypothetical protein 0.017 0.1056 0.2495
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi nuclear hormone receptor 0.0517 0.4114 0.4114
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.029 0.2111 0.5084
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0517 0.4114 0.4114
Brugia malayi tailless protein 0.0227 0.1563 0.1563
Loa Loa (eye worm) hypothetical protein 0.0517 0.4114 0.4114
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0517 0.4114 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0517 0.4114 1
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0517 0.4114 0.4114
Brugia malayi nuclear receptor NHR-88 0.0227 0.1563 0.1563
Schistosoma mansoni RAR-like nuclear receptor 0.0517 0.4114 1
Schistosoma mansoni coup transcription factor 0.0517 0.4114 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0517 0.4114 0.5804
Loa Loa (eye worm) steroid hormone receptor 0.1141 0.9611 0.9611
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0517 0.4114 0.5804
Brugia malayi nuclear receptor RXR 0.0227 0.1563 0.1563
Brugia malayi nuclear hormone receptor 0.0227 0.1563 0.1563
Brugia malayi Steroid receptor seven-up type 2 0.0517 0.4114 0.4114
Brugia malayi photoreceptor-specific nuclear receptor 0.0517 0.4114 0.4114
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0517 0.4114 0.5804
Loa Loa (eye worm) nuclear hormone receptor 0.0227 0.1563 0.1563
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0517 0.4114 0.4114
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0517 0.4114 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0517 0.4114 1
Brugia malayi orphan nuclear receptor NR2E1 0.0227 0.1563 0.1563
Schistosoma mansoni nuclear receptor 0.0227 0.1563 0.374
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0517 0.4114 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.029 0.2111 0.2951
Echinococcus granulosus nuclear receptor nhr 48 0.0227 0.1563 0.2171
Onchocerca volvulus 0.0227 0.1563 0.1219
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0227 0.1563 0.374
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0517 0.4114 0.5804
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.029 0.2111 0.5084
Brugia malayi nuclear receptor RXR 0.029 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.0227 0.1563 0.1563
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0517 0.4114 0.4114
Schistosoma mansoni hypothetical protein 0.0291 0.212 0.5107
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0517 0.4114 1
Schistosoma mansoni alpha-glucosidase 0.0141 0.0798 0.1862
Schistosoma mansoni steroid hormone receptor ad4bp 0.0517 0.4114 1

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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