Detailed information for compound 1596487

Basic information

Technical information
  • TDR Targets ID: 1596487
  • Name: furan-2-yl-[4-[3-methyl-1-(1-propan-2-yltetra zol-5-yl)butyl]piperazin-1-yl]methanone
  • MW: 360.454 | Formula: C18H28N6O2
  • H donors: 0 H acceptors: 4 LogP: 2.19 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(CC(c1nnnn1C(C)C)N1CCN(CC1)C(=O)c1ccco1)C
  • InChi: 1S/C18H28N6O2/c1-13(2)12-15(17-19-20-21-24(17)14(3)4)22-7-9-23(10-8-22)18(25)16-6-5-11-26-16/h5-6,11,13-15H,7-10,12H2,1-4H3
  • InChiKey: HFRJCHREFRERKH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-furyl-[4-[1-(1-isopropyltetrazol-5-yl)-3-methyl-butyl]piperazin-1-yl]methanone
  • 2-furyl-[4-[1-(1-isopropyl-5-tetrazolyl)-3-methylbutyl]-1-piperazinyl]methanone
  • furan-2-yl-[4-[3-methyl-1-(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)butyl]piperazin-1-yl]methanone
  • Oprea1_152708
  • ASN 05554094

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
Toxoplasma gondii cytochrome p450 superfamily protein 0.0019 0.0012 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.2696 1 1
Schistosoma mansoni hypothetical protein 0.0031 0.0057 0.0057
Brugia malayi hypothetical protein 0.0026 0.004 0.004
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0019 0.0012 0.0012
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.0377 0.0377
Schistosoma mansoni serine/threonine protein kinase 0.2696 1 1
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0031 0.0057 0.0057
Trypanosoma cruzi polo-like protein kinase, putative 0.2696 1 1
Schistosoma mansoni vesicular amine transporter 0.0026 0.004 0.004
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0019 0.0012 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.2696 1 1
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0019 0.0012 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.2696 1 1
Schistosoma mansoni hypothetical protein 0.0031 0.0057 0.0057
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0019 0.0012 1
Echinococcus granulosus cytochrome P450 2K1 0.0019 0.0012 0.0012
Loa Loa (eye worm) hypothetical protein 0.0295 0.1041 0.1041
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0019 0.0012 1
Echinococcus granulosus defective proboscis extension response 0.0026 0.004 0.004
Brugia malayi Cytochrome P450 family protein 0.0028 0.0046 0.0046
Echinococcus multilocularis roundabout 2 0.0032 0.0061 0.0061
Echinococcus granulosus roundabout 2 0.0032 0.0061 0.0061
Loa Loa (eye worm) hypothetical protein 0.0031 0.0057 0.0057
Brugia malayi hypothetical protein 0.0295 0.1041 0.1041
Loa Loa (eye worm) CYP4Cod1 0.0028 0.0046 0.0046
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0015 0 0.5
Loa Loa (eye worm) cytochrome P450 0.0019 0.0012 0.0012
Echinococcus granulosus Serine:threonine protein kinase PLK4 0.1011 0.3715 0.3715
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0019 0.0012 1
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0026 0.004 0.004
Brugia malayi Immunoglobulin I-set domain containing protein 0.0026 0.004 0.004
Brugia malayi cytochrome P450 0.0019 0.0012 0.0012
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0031 0.0057 0.0057
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0019 0.0012 1
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0029 0.0052 0.0052
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0026 0.004 0.004
Echinococcus granulosus geminin 0.0165 0.0559 0.0559
Schistosoma mansoni hypothetical protein 0.0031 0.0057 0.0057
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0097 0.0305 0.0305
Echinococcus multilocularis neuroglian 0.0029 0.0049 0.0049
Trypanosoma cruzi cytochrome P450, putative 0.0028 0.0046 0.0046
Schistosoma mansoni hypothetical protein 0.0165 0.0559 0.0559
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0031 0.0057 0.0057
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0019 0.0012 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0019 0.0012 0.0012
Schistosoma mansoni hypothetical protein 0.0019 0.0012 0.0012
Trypanosoma cruzi cytochrome P450, putative 0.0028 0.0046 0.0046
Leishmania major cytochrome p450-like protein 0.0019 0.0012 0.0012
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0059 0.0162 0.0162
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0016 0.0002 0.0002
Brugia malayi MH2 domain containing protein 0.0116 0.0377 0.0377
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Echinococcus granulosus Immunoglobulin 0.0026 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0066 0.019 0.019
Schistosoma mansoni hypothetical protein 0.0031 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0032 0.0061 0.0061
Schistosoma mansoni cytochrome P450 0.0019 0.0012 0.0012
Brugia malayi Immunoglobulin I-set domain containing protein 0.0177 0.0602 0.0602
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0019 0.0012 1
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0019 0.0012 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.0305 0.0305
Leishmania major cytochrome p450-like protein 0.0019 0.0012 0.0012
Mycobacterium leprae Conserved hypothetical protein 0.0019 0.0012 0.5
Loa Loa (eye worm) hypothetical protein 0.0032 0.0061 0.0061
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0097 0.0305 0.0305
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0019 0.0012 0.0012
Brugia malayi Cytochrome P450 family protein 0.0019 0.0012 0.0012
Schistosoma mansoni hypothetical protein 0.0035 0.0073 0.0073
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.2696 1 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0073 0.0073
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.0046 0.0046
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0019 0.0012 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0031 0.0057 0.0057
Onchocerca volvulus 0.0295 0.1041 0.0586
Brugia malayi Fibronectin type III domain containing protein 0.0026 0.004 0.004
Giardia lamblia Kinase, PLK 0.2696 1 0.5
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0019 0.0012 1
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.2696 1 1
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0019 0.0012 1
Onchocerca volvulus Tyrosine kinase homolog 0.015 0.0502 0.0019
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0097 0.0305 0.0305
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0057 0.0057
Echinococcus granulosus GPCR family 2 0.0031 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0165 0.0559 0.0559
Schistosoma mansoni cell adhesion molecule 0.0029 0.0052 0.0052
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0019 0.0012 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0073 0.0073
Echinococcus multilocularis 0.0019 0.0012 0.0012
Leishmania major cytochrome p450-like protein 0.0028 0.0046 0.0046
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Echinococcus granulosus twitchin 0.0039 0.0087 0.0087
Loa Loa (eye worm) hypothetical protein 0.0029 0.0052 0.0052
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0057 0.0057
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Echinococcus multilocularis GPCR, family 2 0.0031 0.0057 0.0057
Echinococcus granulosus neuroglian 0.0029 0.0049 0.0049
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0019 0.0012 1
Trypanosoma cruzi polo-like protein kinase, putative 0.2696 1 1
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0019 0.0012 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0019 0.0012 1
Echinococcus multilocularis Immunoglobulin 0.0026 0.004 0.004
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Echinococcus multilocularis Serine:threonine protein kinase PLK4 0.1011 0.3715 0.3715
Trichomonas vaginalis CAMK family protein kinase 0.2696 1 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0028 0.0046 1
Trypanosoma brucei polo-like protein kinase 0.2696 1 1
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.0377 0.0377
Brugia malayi latrophilin 2 splice variant baaae 0.0066 0.019 0.019
Brugia malayi hypothetical protein 0.0035 0.0073 0.0073
Schistosoma mansoni kinase 0.2584 0.9581 0.9581
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0026 0.004 0.004
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0019 0.0012 1
Brugia malayi Cytochrome P450 family protein 0.0028 0.0046 0.0046
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0073 0.0073
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0019 0.0012 1
Echinococcus multilocularis Immunoglobulin 0.0026 0.004 0.004
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0019 0.0012 0.0012
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0057 0.0057
Brugia malayi Cytochrome P450 family protein 0.0059 0.0162 0.0162
Mycobacterium leprae putative cytochrome p450 0.0019 0.0012 0.5
Schistosoma mansoni hypothetical protein 0.0066 0.019 0.019
Schistosoma mansoni nephrin 0.0029 0.0049 0.0049
Trypanosoma brucei cytochrome P450, putative 0.0028 0.0046 0.0046
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0019 0.0012 0.0012
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.0046 0.0046
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0019 0.0012 1
Echinococcus multilocularis geminin 0.0165 0.0559 0.0559
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0026 0.004 0.004
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0177 0.0602 0.0602
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0019 0.0012 1
Echinococcus granulosus serine:threonine protein kinase PLK1 0.2696 1 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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