Detailed information for compound 618721

Basic information

Technical information
  • TDR Targets ID: 618721
  • Name: N-(6-chloro-1,3-benzothiazol-2-yl)cyclohexane carboxamide
  • MW: 294.8 | Formula: C14H15ClN2OS
  • H donors: 1 H acceptors: 2 LogP: 4.6 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1CCCCC1)Nc1nc2c(s1)cc(cc2)Cl
  • InChi: 1S/C14H15ClN2OS/c15-10-6-7-11-12(8-10)19-14(16-11)17-13(18)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17,18)
  • InChiKey: BCLMENCYPRHQAM-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • IFLab1_001292
  • Oprea1_632776
  • ZINC00362135
  • IDI1_009159
  • AN-652/11844319

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) hypothetical protein 0.0184 0.0315 0.0414
Loa Loa (eye worm) steroid hormone receptor 0.0638 0.7607 1
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0347 0.2943 0.3869
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0347 0.2943 0.631
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0347 0.2943 0.3869
Brugia malayi hypothetical protein 0.0184 0.0315 0.0414
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0347 0.2943 0.3869
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0184 0.0315 0.0414
Schistosoma mansoni thyroid hormone receptor 0.0347 0.2943 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0347 0.2943 0.2943
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0184 0.0315 0.0414
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0347 0.2943 0.631
Brugia malayi Steroid receptor seven-up type 2 0.0347 0.2943 0.3869
Schistosoma mansoni steroid hormone receptor ad4bp 0.0347 0.2943 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0347 0.2943 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0347 0.2943 0.2943
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0347 0.2943 0.631
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0347 0.2943 0.3869
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0347 0.2943 0.2943
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0184 0.0315 0.1071
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0347 0.2943 0.3869
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0347 0.2943 0.3869
Echinococcus granulosus thyroid hormone receptor alpha 0.0455 0.4664 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0347 0.2943 0.3869
Schistosoma mansoni thyroid hormone receptor 0.0347 0.2943 1
Schistosoma mansoni nuclear hormone receptor 0.0347 0.2943 1
Brugia malayi Nuclear hormone receptor-like 1 0.0184 0.0315 0.0414
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0184 0.0315 0.0315
Brugia malayi nuclear receptor RXR 0.0184 0.0315 0.0414
Brugia malayi ecdysteroid receptor 0.0347 0.2943 0.3869
Schistosoma mansoni retinoic acid receptor RXR 0.0347 0.2943 1
Echinococcus multilocularis FTZ F1 alpha 0.0347 0.2943 0.2943
Schistosoma mansoni RAR-like nuclear receptor 0.0347 0.2943 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0347 0.2943 0.3869
Onchocerca volvulus Bile acid receptor homolog 0.0347 0.2943 0.4714
Brugia malayi Nuclear hormone receptor-like 1 0.0347 0.2943 0.3869
Schistosoma mansoni coup transcription factor 0.0347 0.2943 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0347 0.2943 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0553 0.6244 1
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0347 0.2943 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0347 0.2943 0.4714
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0347 0.2943 0.3869
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0184 0.0315 0.0676
Echinococcus granulosus FTZ F1 alpha 0.0347 0.2943 0.631
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0347 0.2943 0.3869
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0347 0.2943 1
Loa Loa (eye worm) hypothetical protein 0.0184 0.0315 0.0414
Brugia malayi Nuclear hormone receptor-like 1 0.0184 0.0315 0.0414
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0347 0.2943 0.3869
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0347 0.2943 0.3869
Echinococcus multilocularis thyroid hormone receptor alpha 0.0347 0.2943 0.2943
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Echinococcus granulosus ecdysone induced protein 78C 0.0347 0.2943 0.631
Brugia malayi nuclear hormone receptor 0.037 0.3301 0.4339
Echinococcus multilocularis ecdysone induced protein 78C 0.0347 0.2943 0.2943
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0347 0.2943 0.631
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0347 0.2943 0.3869
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0347 0.2943 0.2943
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0184 0.0315 0.1071
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0347 0.2943 0.631
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0347 0.2943 0.2943
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0184 0.0315 0.0414
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0347 0.2943 0.3869
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0347 0.2943 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0347 0.2943 0.631
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Brugia malayi steroid hormone receptor 0.0638 0.7607 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0347 0.2943 0.3869
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0347 0.2943 0.3869
Brugia malayi nuclear receptor NHR-88 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0184 0.0315 0.0414
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0347 0.2943 1
Brugia malayi hypothetical protein 0.0184 0.0315 0.0414
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0347 0.2943 0.3869
Loa Loa (eye worm) nuclear receptor nhr-7B 0.037 0.3301 0.4339
Onchocerca volvulus 0.0347 0.2943 0.4714
Brugia malayi nuclear hormone receptor 0.0347 0.2943 0.3869
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0347 0.2943 0.3869
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0347 0.2943 0.2943
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0347 0.2943 0.3869
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0347 0.2943 0.631
Loa Loa (eye worm) hypothetical protein 0.0347 0.2943 0.3869
Loa Loa (eye worm) hypothetical protein 0.0206 0.0673 0.0885

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific proteases (SENPs) using a Caspase-3 Selectivity assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2599, AID434973, AID489001] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 6 (SENP6) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2582, AID2599] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 7 (SENP7) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID434973, AID434986] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 8 (SENP8) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2575] ChEMBL. No reference

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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