Detailed information for compound 905262

Basic information

Technical information
  • TDR Targets ID: 905262
  • Name: 4-cyclohexyl-N-(3-iodophenyl)piperazine-1-car boxamide
  • MW: 413.296 | Formula: C17H24IN3O
  • H donors: 1 H acceptors: 1 LogP: 3.38 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Ic1cccc(c1)NC(=O)N1CCN(CC1)C1CCCCC1
  • InChi: 1S/C17H24IN3O/c18-14-5-4-6-15(13-14)19-17(22)21-11-9-20(10-12-21)16-7-2-1-3-8-16/h4-6,13,16H,1-3,7-12H2,(H,19,22)
  • InChiKey: XMRNPGFVCBBBKK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-cyclohexyl-N-(3-iodophenyl)-1-piperazinecarboxamide
  • Oprea1_083669

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
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0575
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.018 0.7093 0.7093
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0575
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Schistosoma mansoni thyroid hormone receptor 0.015 0.5815 0.9659
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1077 0.4683
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.2299 1
Loa Loa (eye worm) hypothetical protein 0.0082 0.289 0.289
Schistosoma mansoni survival motor neuron protein 0.0051 0.1531 0.2387
Leishmania major cysteine peptidase A (CPA) 0.0018 0.0132 0.0575
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1077 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Entamoeba histolytica cysteine protease, putative 0.0018 0.0132 0.1227
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0132 0.0013
Schistosoma mansoni zinc finger protein 0.0023 0.0338 0.0362
Loa Loa (eye worm) MH2 domain-containing protein 0.0134 0.5133 0.5133
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1077 1
Schistosoma mansoni hypothetical protein 0.0051 0.1531 0.2387
Brugia malayi RNA binding protein 0.0146 0.5631 0.5631
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Leishmania major hypothetical protein, conserved 0.0018 0.0124 0.0541
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.1077 0.0957
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0018 0.0132 0.0132
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.1077 1
Loa Loa (eye worm) ctsf protein 0.0018 0.0132 0.0132
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0042 0.1154 0.1035
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Onchocerca volvulus 0.0018 0.0132 0.0345
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Onchocerca volvulus 0.0104 0.3833 1
Loa Loa (eye worm) PHD-finger family protein 0.0024 0.039 0.039
Leishmania major alpha glucosidase II subunit, putative 0.004 0.1077 0.4683
Trypanosoma cruzi ISWI complex protein 0.0018 0.0124 0.0541
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1077 1
Brugia malayi TAR-binding protein 0.0146 0.5631 0.5631
Schistosoma mansoni alpha-glucosidase 0.0155 0.6017 1
Leishmania major cathepsin L-like protease 0.0068 0.2299 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0139 0.5336 0.5273
Schistosoma mansoni tar DNA-binding protein 0.0146 0.5631 0.9346
Echinococcus granulosus methyl CpG binding domain protein 2 0.002 0.0212 0.0081
Echinococcus multilocularis thyroid hormone receptor alpha 0.015 0.5815 0.5759
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Plasmodium vivax vivapain-2 0.0018 0.0132 0.5
Schistosoma mansoni tar DNA-binding protein 0.0146 0.5631 0.9346
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Schistosoma mansoni alpha glucosidase 0.004 0.1077 0.1616
Echinococcus granulosus survival motor neuron protein 1 0.0248 1 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0051 0.1531 0.1531
Echinococcus granulosus fetal alzheimer antigen falz 0.0026 0.0486 0.0358
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.0212 0.0149
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Echinococcus granulosus zinc finger protein 0.0023 0.0338 0.0208
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0212 0.0149
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0575
Echinococcus multilocularis tar DNA binding protein 0.0146 0.5631 0.5573
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0018 0.0132 0.1227
Loa Loa (eye worm) hypothetical protein 0.0248 1 1
Trypanosoma cruzi ISWI complex protein 0.0018 0.0124 0.0541
Echinococcus multilocularis zinc finger protein 0.0023 0.0338 0.0208
Schistosoma mansoni hypothetical protein 0.0024 0.039 0.0452
Trypanosoma cruzi cysteine peptidase, putative 0.0018 0.0132 0.0575
Echinococcus multilocularis survival motor neuron protein 1 0.0248 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.2299 1
Onchocerca volvulus 0.0018 0.0132 0.0345
Plasmodium falciparum cysteine proteinase falcipain 3 0.0018 0.0132 0.5
Onchocerca volvulus 0.0051 0.1531 0.3994
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0018 0.0132 0.5
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.1077 1
Onchocerca volvulus 0.0018 0.0132 0.0345
Schistosoma mansoni alpha-glucosidase 0.0155 0.6017 1
Brugia malayi RNA recognition motif domain containing protein 0.0146 0.5631 0.5631
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0069 0.234 0.2237
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1077 0.4683
Schistosoma mansoni tar DNA-binding protein 0.0146 0.5631 0.9346
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.002 0.0212 0.0081
Trypanosoma cruzi major cysteine proteinase, putative 0.0054 0.167 0.7265
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Onchocerca volvulus 0.0018 0.0132 0.0345
Brugia malayi PHD-finger family protein 0.0029 0.0604 0.0604
Onchocerca volvulus 0.0018 0.0132 0.0345
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0139 0.5336 0.5273
Echinococcus granulosus histone lysine methyltransferase setb 0.002 0.0212 0.0081
Entamoeba histolytica cysteine proteinase, putative 0.0018 0.0132 0.1227
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1077 1
Brugia malayi Bromodomain containing protein 0.0044 0.1272 0.1272
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.1077 0.0957
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Onchocerca volvulus Cathepsin L homolog 0.0018 0.0132 0.0345
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0575
Trypanosoma cruzi cruzipain precursor, putative 0.0068 0.2299 1
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0132 0.0013
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0242 0.0242
Loa Loa (eye worm) hypothetical protein 0.005 0.1489 0.1489
Loa Loa (eye worm) hypothetical protein 0.002 0.0212 0.0212
Echinococcus granulosus tar DNA binding protein 0.0146 0.5631 0.5573
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Loa Loa (eye worm) TAR-binding protein 0.0146 0.5631 0.5631
Echinococcus multilocularis lysosomal alpha glucosidase 0.018 0.7093 0.7054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Entamoeba histolytica cysteine proteinase, putative 0.0018 0.0132 0.1227
Echinococcus multilocularis lysosomal alpha glucosidase 0.018 0.7093 0.7054
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.1077 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1077 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1077 1
Brugia malayi MH2 domain containing protein 0.0134 0.5133 0.5133
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Schistosoma mansoni tar DNA-binding protein 0.0146 0.5631 0.9346
Onchocerca volvulus Cathepsin L homolog 0.0018 0.0132 0.0345
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0069 0.234 0.2237
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1077 1
Plasmodium vivax vivapain-2 0.0018 0.0132 0.5
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0062 0.2044 0.8891
Loa Loa (eye worm) hypothetical protein 0.0045 0.1275 0.1275
Onchocerca volvulus 0.0018 0.0132 0.0345
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0212 0.0149
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Schistosoma mansoni bromodomain containing protein 0.0073 0.2518 0.4063
Schistosoma mansoni thyroid hormone receptor 0.015 0.5815 0.9659
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0042 0.1154 0.1035
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Loa Loa (eye worm) cysteine protease 0.0018 0.0132 0.0132
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1077 1
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.2299 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.1227
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1077 1
Loa Loa (eye worm) RNA binding protein 0.0146 0.5631 0.5631
Echinococcus multilocularis methyl CpG binding domain protein 2 0.002 0.0212 0.0081
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0146 0.5631 0.5631
Loa Loa (eye worm) hypothetical protein 0.0018 0.0132 0.0132
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Brugia malayi Bromodomain containing protein 0.0087 0.3103 0.3103
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Leishmania major cathepsin L-like protease 0.0068 0.2299 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0018 0.0132 0.5
Leishmania major cathepsin L-like protease 0.0068 0.2299 1
Trypanosoma brucei glucosidase, putative 0.004 0.1077 0.4683
Echinococcus granulosus lysosomal alpha glucosidase 0.018 0.7093 0.7054
Loa Loa (eye worm) transcription factor SMAD2 0.0134 0.5133 0.5133
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.1077 0.1077
Onchocerca volvulus 0.0018 0.0132 0.0345
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Schistosoma mansoni hypothetical protein 0.0139 0.5336 0.8845
Loa Loa (eye worm) hypothetical protein 0.0047 0.1393 0.1393
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.0212 0.0149
Schistosoma mansoni tar DNA-binding protein 0.0146 0.5631 0.9346
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.1227
Brugia malayi Glycosyl hydrolases family 31 protein 0.018 0.7093 0.7093
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0018 0.0132 0.1227
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.1077 0.1077
Trypanosoma brucei ISWI complex protein 0.0018 0.0124 0.0541
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0575
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0018 0.0132 0.0132
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0026 0.0486 0.0358
Loa Loa (eye worm) fibroinase 0.0018 0.0132 0.0132
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0026 0.0486 0.0613
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0132 0.0132
Onchocerca volvulus Cathepsin F homolog 0.0018 0.0132 0.0345
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.2299 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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.